N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide

C15H15N3O2 — CID 47160867

IUPACN-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(CNC(=O)c2ccccn2)cc1
InChIInChI=1S/C15H15N3O2/c1-16-14(19)12-7-5-11(6-8-12)10-18-15(20)13-4-2-3-9-17-13/h2-9H,10H2,1H3,(H,16,19)(H,18,20)
InChIKeyAZVFRMFFMXKYSE-UHFFFAOYSA-N
MW269.30 g/mol
LogP1.37
Rot. Bonds4

About N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide

N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide (PubChem CID 47160867) has the molecular formula C15H15N3O2 and a molecular weight of 269.30 g/mol. Its IUPAC name is N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide
PubChem CID47160867
Molecular FormulaC15H15N3O2
Molecular Weight269.30 g/mol
Exact Mass269.12
IUPAC NameN-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide
SMILESCNC(=O)c1ccc(CNC(=O)c2ccccn2)cc1
InChIInChI=1S/C15H15N3O2/c1-16-14(19)12-7-5-11(6-8-12)10-18-15(20)13-4-2-3-9-17-13/h2-9H,10H2,1H3,(H,16,19)(H,18,20)
InChIKeyAZVFRMFFMXKYSE-UHFFFAOYSA-N
XLogP1.37
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide
CID 108743925
N-[(4-ethylsulfonylphenyl)methyl]pyridine-2-carboxamide
CID 110794533
N-[[4-(2-methoxyethoxy)phenyl]methyl]pyridine-2-carboxamide
CID 110793787
N-[[4-(1,2,4,5-tetrazin-3-yl)phenyl]methyl]pyridine-2-carboxamide
CID 164536999
N-benzyl-4-[methyl-[[4-(methylcarbamoyl)phenyl]methyl]amino]pyridine-2-carboxamide
CID 75463659
4-(methylaminomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 90338069
N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide
CID 18119444
4-(acetamidomethyl)-N-(pyridin-2-ylmethyl)benzamide
CID 18107584
N-[(3,5-dimethoxyphenyl)methyl]pyridine-2-carboxamide
CID 47024016
N-[[3-(dimethylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide
CID 46415352
N-[[4-(methylcarbamoyl)phenyl]methyl]-4-pyridin-2-ylpiperazine-1-carboxamide
CID 134006342
4-[(carbamoylamino)methyl]-N-methylbenzamide
CID 39969427

Frequently Asked Questions

What is the IUPAC name of N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide?
The IUPAC name of N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide (CID 47160867) is N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide?
The canonical SMILES for N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide is CNC(=O)c1ccc(CNC(=O)c2ccccn2)cc1.
What is the InChIKey of N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide?
The InChIKey is AZVFRMFFMXKYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3O2/c1-16-14(19)12-7-5-11(6-8-12)10-18-15(20)13-4-2-3-9-17-13/h2-9H,10H2,1H3,(H,16,19)(H,18,20).
What are the key properties of N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide?
N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide has a molecular weight of 269.30 g/mol, XLogP of 1.37, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide is sourced from PubChem (CID 47160867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).