N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide

C22H21N3O3 — CID 51125047

IUPACN-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide
SMILESNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)c1ccccn1
InChIInChI=1S/C22H21N3O3/c23-21(26)15-25(22(27)20-8-4-5-13-24-20)14-17-9-11-19(12-10-17)28-16-18-6-2-1-3-7-18/h1-13H,14-16H2,(H2,23,26)
InChIKeyFRVFPJQVOSVZSJ-UHFFFAOYSA-N
MW375.43 g/mol
LogP2.79
Rot. Bonds8

About N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide

N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide (PubChem CID 51125047) has the molecular formula C22H21N3O3 and a molecular weight of 375.43 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide
PubChem CID51125047
Molecular FormulaC22H21N3O3
Molecular Weight375.43 g/mol
Exact Mass375.16
IUPAC NameN-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide
SMILESNC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)c1ccccn1
InChIInChI=1S/C22H21N3O3/c23-21(26)15-25(22(27)20-8-4-5-13-24-20)14-17-9-11-19(12-10-17)28-16-18-6-2-1-3-7-18/h1-13H,14-16H2,(H2,23,26)
InChIKeyFRVFPJQVOSVZSJ-UHFFFAOYSA-N
XLogP2.79
TPSA85.52 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.43
LogP ≤ 52.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-N-[(4-phenylmethoxyphenyl)methyl]quinoxaline-2-carboxamide
CID 9489163
(2S)-2-(dibenzylamino)-3-(4-phenylmethoxyphenyl)propanoic acid
CID 10575593
N-benzyl-N-octylpyridine-2-carboxamide
CID 42778827
N-[(4-phenylmethoxyphenyl)methyl]-N-pyridin-2-ylfuran-2-carboxamide
CID 35574865
[2-oxo-2-(4-phenylmethoxyanilino)ethyl] pyridine-2-carboxylate
CID 7866583
2-(2-aminoethyl)-N-(2-amino-2-oxoethyl)-N-benzyl-1,3-thiazole-4-carboxamide;hydrochloride
CID 120632455
N,N-diethyl-4-phenylmethoxybenzamide
CID 4958372
N-(pyridin-2-ylmethyl)-N-(pyridin-3-ylmethyl)pyridine-2-carboxamide
CID 102199988
3-[methyl-[(4-phenylmethoxyphenyl)methyl]amino]propanoic acid
CID 119134997
3-hydroxy-3-(4-phenylmethoxyphenyl)propanamide
CID 110024303
N-benzyl-N-propan-2-ylpyridine-2-carboxamide
CID 42778097
2-oxo-2-[(4-phenylmethoxyphenyl)methoxy]acetic acid
CID 57045753

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide (CID 51125047) is N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide is NC(=O)CN(Cc1ccc(OCc2ccccc2)cc1)C(=O)c1ccccn1.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide?
The InChIKey is FRVFPJQVOSVZSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O3/c23-21(26)15-25(22(27)20-8-4-5-13-24-20)14-17-9-11-19(12-10-17)28-16-18-6-2-1-3-7-18/h1-13H,14-16H2,(H2,23,26).
What are the key properties of N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide?
N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide has a molecular weight of 375.43 g/mol, XLogP of 2.79, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-[(4-phenylmethoxyphenyl)methyl]pyridine-2-carboxamide is sourced from PubChem (CID 51125047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).