4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide

C20H22N4O2 — CID 125436427

IUPAC4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide
SMILESCc1cc(-c2ccc(C(=O)NC[C@@H](C)n3ccnc3)cc2)c(=O)[nH]c1C
InChIInChI=1S/C20H22N4O2/c1-13-10-18(20(26)23-15(13)3)16-4-6-17(7-5-16)19(25)22-11-14(2)24-9-8-21-12-24/h4-10,12,14H,11H2,1-3H3,(H,22,25)(H,23,26)/t14-/m1/s1
InChIKeySGVRWSBSSJLCTA-CQSZACIVSA-N
MW350.42 g/mol
LogP2.85
Rot. Bonds5

About 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide

4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide (PubChem CID 125436427) has the molecular formula C20H22N4O2 and a molecular weight of 350.42 g/mol. Its IUPAC name is 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide.

Molecular Properties

Compound Name4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide
PubChem CID125436427
Molecular FormulaC20H22N4O2
Molecular Weight350.42 g/mol
Exact Mass350.17
IUPAC Name4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide
SMILESCc1cc(-c2ccc(C(=O)NC[C@@H](C)n3ccnc3)cc2)c(=O)[nH]c1C
InChIInChI=1S/C20H22N4O2/c1-13-10-18(20(26)23-15(13)3)16-4-6-17(7-5-16)19(25)22-11-14(2)24-9-8-21-12-24/h4-10,12,14H,11H2,1-3H3,(H,22,25)(H,23,26)/t14-/m1/s1
InChIKeySGVRWSBSSJLCTA-CQSZACIVSA-N
XLogP2.85
TPSA79.78 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.42
LogP ≤ 52.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide 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

4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2S)-2-imidazol-1-ylpropyl]benzamide
CID 125436426
4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-(2-ethylsulfanylethyl)benzamide
CID 122571299
5-ethyl-N-(2-imidazol-1-ylpropyl)-1H-pyrrole-2-carboxamide
CID 91791046
1-ethyl-N-[(2R)-2-imidazol-1-ylpropyl]-3-propan-2-ylpyrazole-5-carboxamide
CID 97143013
3-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(1-propylimidazol-2-yl)methyl]benzamide
CID 122558606
tert-butyl N-(2-imidazol-1-ylpropyl)carbamate
CID 151187469
2-(2,4-dimethoxyphenyl)-N-(2-imidazol-1-ylpropyl)acetamide
CID 91841839
3-[4-[(1S)-1-ethoxyethyl]phenyl]-5,6-dimethyl-1H-pyridin-2-one
CID 164642017
4-(4-chlorophenyl)-N-[2-imidazol-1-yl-3-(4-methoxyphenyl)propyl]benzamide
CID 53348140
N-(3-hydroxy-2-methylpropyl)-4-pyrazol-1-ylbenzamide
CID 65031869
N-[(2R)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]-3,5,7-trimethyl-1H-indole-2-carboxamide
CID 51498035
N-(2-imidazol-1-yl-2-phenylethyl)-4-[(E)-2-(4-methoxyphenyl)ethenyl]benzamide
CID 118712540

Frequently Asked Questions

What is the IUPAC name of 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide?
The IUPAC name of 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide (CID 125436427) is 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide.
What is the SMILES notation for 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide?
The canonical SMILES for 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide is Cc1cc(-c2ccc(C(=O)NC[C@@H](C)n3ccnc3)cc2)c(=O)[nH]c1C.
What is the InChIKey of 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide?
The InChIKey is SGVRWSBSSJLCTA-CQSZACIVSA-N. The full InChI is InChI=1S/C20H22N4O2/c1-13-10-18(20(26)23-15(13)3)16-4-6-17(7-5-16)19(25)22-11-14(2)24-9-8-21-12-24/h4-10,12,14H,11H2,1-3H3,(H,22,25)(H,23,26)/t14-/m1/s1.
What are the key properties of 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide?
4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide has a molecular weight of 350.42 g/mol, XLogP of 2.85, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5,6-dimethyl-2-oxo-1H-pyridin-3-yl)-N-[(2R)-2-imidazol-1-ylpropyl]benzamide is sourced from PubChem (CID 125436427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).