A1A3W

(1R)-N-methyl-1-(pyridin-4-yl)propan-1-amine

Created:2024-08-29
Last modified:  2024-11-06

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Chemical Details

Formal Charge0
Atom Count25
Chiral Atom Count1
Bond Count25
Aromatic Bond Count6
2D diagram of A1A3W

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Chemical Component Summary

Name(1R)-N-methyl-1-(pyridin-4-yl)propan-1-amine
Systematic Name (OpenEye OEToolkits)(1~{S})-~{N}-methyl-1-pyridin-4-yl-propan-1-amine
FormulaC9 H14 N2
Molecular Weight150.221
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs14.52CNC(CC)c1ccncc1
SMILESCACTVS3.385CC[CH](NC)c1ccncc1
SMILESOpenEye OEToolkits3.1.0.0CCC(c1ccncc1)NC
Canonical SMILESCACTVS3.385 CC[C@H](NC)c1ccncc1
Canonical SMILESOpenEye OEToolkits3.1.0.0 CC[C@@H](c1ccncc1)NC
InChIInChI1.06 InChI=1S/C9H14N2/c1-3-9(10-2)8-4-6-11-7-5-8/h4-7,9-10H,3H2,1-2H3/t9-/m1/s1
InChIKeyInChI1.06 LOFCJGPTBIGJGR-SECBINFHSA-N

Related Resource References

Resource NameReference
PubChem 93312901