2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide

C14H16N4O — CID 55204056

IUPAC2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NCc2ncccc2C)ccn1
InChIInChI=1S/C14H16N4O/c1-10-4-3-6-16-12(10)9-18-14(19)11-5-7-17-13(8-11)15-2/h3-8H,9H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyRWHJEVVJUVYNSM-UHFFFAOYSA-N
MW256.31 g/mol
LogP1.76
Rot. Bonds4

About 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide

2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide (PubChem CID 55204056) has the molecular formula C14H16N4O and a molecular weight of 256.31 g/mol. Its IUPAC name is 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide
PubChem CID55204056
Molecular FormulaC14H16N4O
Molecular Weight256.31 g/mol
Exact Mass256.13
IUPAC Name2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide
SMILESCNc1cc(C(=O)NCc2ncccc2C)ccn1
InChIInChI=1S/C14H16N4O/c1-10-4-3-6-16-12(10)9-18-14(19)11-5-7-17-13(8-11)15-2/h3-8H,9H2,1-2H3,(H,15,17)(H,18,19)
InChIKeyRWHJEVVJUVYNSM-UHFFFAOYSA-N
XLogP1.76
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.31
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-[(3-methyl-2-pyridinyl)methylcarbamoyl]benzoic acid
CID 63309087
4-hydroxy-3-methyl-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 103956033
4-fluoro-3-methyl-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 55205389
2-(methylamino)-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 62166427
2-(ethylamino)-N-[(3-ethyl-2-pyridinyl)methyl]pyridine-4-carboxamide
CID 82734231
2-(methylamino)-N-(thiophen-2-ylmethyl)pyridine-4-carboxamide
CID 55042664
4-amino-3,5-difluoro-N-[(3-methyl-2-pyridinyl)methyl]benzamide
CID 63309173
5-bromo-N-[(3-methyl-2-pyridinyl)methyl]thiophene-3-carboxamide
CID 63310048
N-(1H-imidazol-2-ylmethyl)-2-(methylamino)pyridine-4-carboxamide
CID 64523208
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-(methylamino)pyridine-4-carboxamide
CID 106377305
2-(methylamino)-N-(2-methylphenyl)pyridine-4-carboxamide
CID 55042330
2-chloro-N-[(3-methyl-2-pyridinyl)methyl]pyridine-3-carboxamide
CID 63306526

Frequently Asked Questions

What is the IUPAC name of 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
The IUPAC name of 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide (CID 55204056) is 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide is CNc1cc(C(=O)NCc2ncccc2C)ccn1.
What is the InChIKey of 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
The InChIKey is RWHJEVVJUVYNSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N4O/c1-10-4-3-6-16-12(10)9-18-14(19)11-5-7-17-13(8-11)15-2/h3-8H,9H2,1-2H3,(H,15,17)(H,18,19).
What are the key properties of 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide?
2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide has a molecular weight of 256.31 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(methylamino)-N-[(3-methyl-2-pyridinyl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 55204056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).