5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide

C22H18N4O2 — CID 46963251

IUPAC5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccncc2)c1C(=O)NC(c1ccccc1)c1cccnc1
InChIInChI=1S/C22H18N4O2/c1-15-19(21(26-28-15)17-9-12-23-13-10-17)22(27)25-20(16-6-3-2-4-7-16)18-8-5-11-24-14-18/h2-14,20H,1H3,(H,25,27)
InChIKeyHKDQDSDIQYKBJT-UHFFFAOYSA-N
MW370.41 g/mol
LogP3.96
Rot. Bonds5

About 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide

5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide (PubChem CID 46963251) has the molecular formula C22H18N4O2 and a molecular weight of 370.41 g/mol. Its IUPAC name is 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide
PubChem CID46963251
Molecular FormulaC22H18N4O2
Molecular Weight370.41 g/mol
Exact Mass370.14
IUPAC Name5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide
SMILESCc1onc(-c2ccncc2)c1C(=O)NC(c1ccccc1)c1cccnc1
InChIInChI=1S/C22H18N4O2/c1-15-19(21(26-28-15)17-9-12-23-13-10-17)22(27)25-20(16-6-3-2-4-7-16)18-8-5-11-24-14-18/h2-14,20H,1H3,(H,25,27)
InChIKeyHKDQDSDIQYKBJT-UHFFFAOYSA-N
XLogP3.96
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.41
LogP ≤ 53.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-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

5-methyl-N-[(R)-(2-methylphenyl)-pyridin-4-ylmethyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide
CID 51495923
N-[(S)-(4-methylphenyl)-pyridin-3-ylmethyl]benzamide
CID 92500168
N-(2-chlorophenyl)-5-methyl-3-pyridin-3-yl-1,2-oxazole-4-carboxamide
CID 53001781
[2-(benzhydrylamino)-2-oxoethyl] 5-methyl-3-phenyl-1,2-oxazole-4-carboxylate
CID 2614483
N-[(4-methylphenyl)-phenylmethyl]pyridine-3-carboxamide
CID 51151137
N-[(2S)-1-(2-methoxyphenyl)propan-2-yl]-5-methyl-3-pyridin-4-yl-1,2-oxazole-4-carboxamide
CID 51498087
N-ethyl-5-methyl-3-pyridin-3-yl-1,2-oxazole-4-carboxamide
CID 53015749
4-methoxy-N-[phenyl(pyridin-3-yl)methyl]benzamide
CID 20896997
5-methyl-3-phenyl-N-[(1R)-1-thiophen-2-ylethyl]-1,2-oxazole-4-carboxamide
CID 40819505
N-[[1-(dimethylamino)cyclopentyl]-phenylmethyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 23728869
N-(2-methoxy-6-pyridin-4-yl-3-pyridinyl)-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 166108834
N-[1-(furan-2-yl)ethyl]-5-methyl-3-phenyl-1,2-oxazole-4-carboxamide
CID 18110349

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide (CID 46963251) is 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide is Cc1onc(-c2ccncc2)c1C(=O)NC(c1ccccc1)c1cccnc1.
What is the InChIKey of 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide?
The InChIKey is HKDQDSDIQYKBJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N4O2/c1-15-19(21(26-28-15)17-9-12-23-13-10-17)22(27)25-20(16-6-3-2-4-7-16)18-8-5-11-24-14-18/h2-14,20H,1H3,(H,25,27).
What are the key properties of 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide?
5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide has a molecular weight of 370.41 g/mol, XLogP of 3.96, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[phenyl(pyridin-3-yl)methyl]-3-pyridin-4-yl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 46963251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).