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

C20H16N4O2S — CID 31153107

IUPAC5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1nc(NC(=O)c2c(-c3ccccc3)noc2C)sc1-c1ccccn1
InChIInChI=1S/C20H16N4O2S/c1-12-18(15-10-6-7-11-21-15)27-20(22-12)23-19(25)16-13(2)26-24-17(16)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,22,23,25)
InChIKeyAYYGLXUXBXVCJY-UHFFFAOYSA-N
MW376.44 g/mol
LogP4.73
Rot. Bonds4

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

5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide (PubChem CID 31153107) has the molecular formula C20H16N4O2S and a molecular weight of 376.44 g/mol. Its IUPAC name is 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide
PubChem CID31153107
Molecular FormulaC20H16N4O2S
Molecular Weight376.44 g/mol
Exact Mass376.10
IUPAC Name5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide
SMILESCc1nc(NC(=O)c2c(-c3ccccc3)noc2C)sc1-c1ccccn1
InChIInChI=1S/C20H16N4O2S/c1-12-18(15-10-6-7-11-21-15)27-20(22-12)23-19(25)16-13(2)26-24-17(16)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,22,23,25)
InChIKeyAYYGLXUXBXVCJY-UHFFFAOYSA-N
XLogP4.73
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.44
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2,6-difluoro-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31171489
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)acetamide
CID 31156282
3-(4-fluorophenyl)-5-methyl-N-[5-(1-methylimidazol-2-yl)-4-phenyl-1,3-thiazol-2-yl]-1,2-oxazole-4-carboxamide
CID 55608043
4-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31154800
6-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 31519632
4-(dimethylamino)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31155104
3-(3-fluorophenyl)-5-methyl-N-(4-pyridin-2-yl-1,3-thiazol-2-yl)-1,2-oxazole-4-carboxamide
CID 176858449
ethyl 2-[(5-methyl-3-phenyl-1,2-oxazole-4-carbonyl)amino]-4-phenyl-1,3-thiazole-5-carboxylate
CID 16566735
2-(4-methylphenyl)-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-1,3-thiazole-4-carboxamide
CID 31156594
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-3-methoxy-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)benzamide
CID 31153670
N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)cyclopropanecarboxamide
CID 31519206
N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-4-propan-2-yloxybenzamide
CID 31154524

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide?
The IUPAC name of 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide (CID 31153107) is 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide.
What is the SMILES notation for 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide?
The canonical SMILES for 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide is Cc1nc(NC(=O)c2c(-c3ccccc3)noc2C)sc1-c1ccccn1.
What is the InChIKey of 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide?
The InChIKey is AYYGLXUXBXVCJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N4O2S/c1-12-18(15-10-6-7-11-21-15)27-20(22-12)23-19(25)16-13(2)26-24-17(16)14-8-4-3-5-9-14/h3-11H,1-2H3,(H,22,23,25).
What are the key properties of 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide?
5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide has a molecular weight of 376.44 g/mol, XLogP of 4.73, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(4-methyl-5-pyridin-2-yl-1,3-thiazol-2-yl)-3-phenyl-1,2-oxazole-4-carboxamide is sourced from PubChem (CID 31153107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).