2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

C14H16N4O — CID 110299234

IUPAC2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)NCc1ccncc1
InChIInChI=1S/C14H16N4O/c1-18(2)13-12(4-3-7-16-13)14(19)17-10-11-5-8-15-9-6-11/h3-9H,10H2,1-2H3,(H,17,19)
InChIKeyVMDFZWLTARCRPK-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.47
Rot. Bonds4

About 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide

2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide (PubChem CID 110299234) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
PubChem CID110299234
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
SMILESCN(C)c1ncccc1C(=O)NCc1ccncc1
InChIInChI=1S/C14H16N4O/c1-18(2)13-12(4-3-7-16-13)14(19)17-10-11-5-8-15-9-6-11/h3-9H,10H2,1-2H3,(H,17,19)
InChIKeyVMDFZWLTARCRPK-UHFFFAOYSA-N
XLogP1.47
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 4165114
2-(dimethylamino)-N-[(1-methylimidazol-2-yl)methyl]pyridine-3-carboxamide
CID 110475162
2-(dimethylamino)-N,N-dimethylpyridine-3-carboxamide
CID 53015798
2-(dimethylamino)-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pyridine-3-carboxamide
CID 110615826
1-[2-[methyl(pyridin-4-ylmethyl)amino]-3-pyridinyl]ethanone
CID 103721785
2-(dimethylamino)-N-[[3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]methyl]pyridine-3-carboxamide
CID 95213762
2-(dimethylamino)-N-phenylpyridine-3-carboxamide
CID 38885522
2-(propan-2-ylamino)-N-(pyridin-4-ylmethyl)benzamide
CID 63107619
2-(2,5-dimethylphenyl)sulfanyl-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide
CID 24628486
N-[[4-(dimethylamino)phenyl]methyl]-2-(4-fluorophenoxy)pyridine-3-carboxamide
CID 22612296
N-[(4-bromophenyl)methyl]-2-methylpyridine-3-carboxamide
CID 78950948
2-fluoro-N-(pyridin-3-ylmethyl)pyridine-3-carboxamide
CID 107358424

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The IUPAC name of 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide (CID 110299234) is 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide.
What is the SMILES notation for 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The canonical SMILES for 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide is CN(C)c1ncccc1C(=O)NCc1ccncc1.
What is the InChIKey of 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
The InChIKey is VMDFZWLTARCRPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-18(2)13-12(4-3-7-16-13)14(19)17-10-11-5-8-15-9-6-11/h3-9H,10H2,1-2H3,(H,17,19).
What are the key properties of 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide?
2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.47, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-N-(pyridin-4-ylmethyl)pyridine-3-carboxamide is sourced from PubChem (CID 110299234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).