Q3F

1-methyl-1H-pyrazol-4-amine

Created:	2022-06-01
Last modified:	2022-12-07

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1 entries where Q3F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	14
Chiral Atom Count	0
Bond Count	14
Aromatic Bond Count	5

2D diagram of Q3F

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Chemical Component Summary
Name	1-methyl-1H-pyrazol-4-amine
Systematic Name (OpenEye OEToolkits)	1-methylpyrazol-4-amine
Formula	C₄ H₇ N₃
Molecular Weight	97.118
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Nc1cn(C)nc1
SMILES	CACTVS	3.385	Cn1cc(N)cn1
SMILES	OpenEye OEToolkits	2.0.7	Cn1cc(cn1)N
Canonical SMILES	CACTVS	3.385	Cn1cc(N)cn1
Canonical SMILES	OpenEye OEToolkits	2.0.7	Cn1cc(cn1)N
InChI	InChI	1.03	InChI=1S/C4H7N3/c1-7-3-4(5)2-6-7/h2-3H,5H2,1H3
InChIKey	InChI	1.03	LBGSWBJURUFGLR-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	4770990

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.