N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide

C14H13N3O2 — CID 108743925

IUPACN-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CNC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H13N3O2/c15-13(18)11-6-4-10(5-7-11)9-17-14(19)12-3-1-2-8-16-12/h1-8H,9H2,(H2,15,18)(H,17,19)
InChIKeyHEZOUFFKMIKIDG-UHFFFAOYSA-N
MW255.28 g/mol
LogP1.11
Rot. Bonds4

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

N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide (PubChem CID 108743925) has the molecular formula C14H13N3O2 and a molecular weight of 255.28 g/mol. Its IUPAC name is N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide
PubChem CID108743925
Molecular FormulaC14H13N3O2
Molecular Weight255.28 g/mol
Exact Mass255.10
IUPAC NameN-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide
SMILESNC(=O)c1ccc(CNC(=O)c2ccccn2)cc1
InChIInChI=1S/C14H13N3O2/c15-13(18)11-6-4-10(5-7-11)9-17-14(19)12-3-1-2-8-16-12/h1-8H,9H2,(H2,15,18)(H,17,19)
InChIKeyHEZOUFFKMIKIDG-UHFFFAOYSA-N
XLogP1.11
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.28
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(methylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide
CID 47160867
N-[[4-(1,2,4,5-tetrazin-3-yl)phenyl]methyl]pyridine-2-carboxamide
CID 164536999
N-[(4-ethylsulfonylphenyl)methyl]pyridine-2-carboxamide
CID 110794533
N-[[4-(2-methoxyethoxy)phenyl]methyl]pyridine-2-carboxamide
CID 110793787
N-[[4-(piperidin-1-ylmethyl)phenyl]methyl]pyridine-2-carboxamide
CID 18119444
N-[(4-carbamoylphenyl)methyl]pyridine-3-carboxamide
CID 108766189
N-[(3-acetamidophenyl)methyl]pyridine-2-carboxamide
CID 46477958
N-[(3,5-dimethoxyphenyl)methyl]pyridine-2-carboxamide
CID 47024016
N-[[3-(pyridine-2-carbonylamino)phenyl]methyl]thiadiazole-4-carboxamide
CID 166190967
2-N-[(4-chlorophenyl)methyl]-6-N-(pyridin-2-ylmethyl)pyridine-2,6-dicarboxamide
CID 109097921
N-[[3-(dimethylcarbamoyl)phenyl]methyl]pyridine-2-carboxamide
CID 46415352
N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyridine-2-carboxamide
CID 8588320

Frequently Asked Questions

What is the IUPAC name of N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide?
The IUPAC name of N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide (CID 108743925) is N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide is NC(=O)c1ccc(CNC(=O)c2ccccn2)cc1.
What is the InChIKey of N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide?
The InChIKey is HEZOUFFKMIKIDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2/c15-13(18)11-6-4-10(5-7-11)9-17-14(19)12-3-1-2-8-16-12/h1-8H,9H2,(H2,15,18)(H,17,19).
What are the key properties of N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide?
N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide has a molecular weight of 255.28 g/mol, XLogP of 1.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-carbamoylphenyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 108743925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).