N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide

C16H14N4O2S — CID 90509804

IUPACN-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
SMILESCOc1cccc(NC(=O)c2csc(Nc3ccccn3)n2)c1
InChIInChI=1S/C16H14N4O2S/c1-22-12-6-4-5-11(9-12)18-15(21)13-10-23-16(19-13)20-14-7-2-3-8-17-14/h2-10H,1H3,(H,18,21)(H,17,19,20)
InChIKeyNBDBIDFBSJUVOL-UHFFFAOYSA-N
MW326.38 g/mol
LogP3.54
Rot. Bonds5

About N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide

N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide (PubChem CID 90509804) has the molecular formula C16H14N4O2S and a molecular weight of 326.38 g/mol. Its IUPAC name is N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
PubChem CID90509804
Molecular FormulaC16H14N4O2S
Molecular Weight326.38 g/mol
Exact Mass326.08
IUPAC NameN-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
SMILESCOc1cccc(NC(=O)c2csc(Nc3ccccn3)n2)c1
InChIInChI=1S/C16H14N4O2S/c1-22-12-6-4-5-11(9-12)18-15(21)13-10-23-16(19-13)20-14-7-2-3-8-17-14/h2-10H,1H3,(H,18,21)(H,17,19,20)
InChIKeyNBDBIDFBSJUVOL-UHFFFAOYSA-N
XLogP3.54
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 53.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-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

N-[3-(difluoromethoxy)phenyl]-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509910
N-phenyl-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509789
N-(6-chloro-3-pyridinyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509919
N-propan-2-yl-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509762
N-(4-methylsulfonylphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509926
2-(pyridin-2-ylamino)-N-quinolin-8-yl-1,3-thiazole-4-carboxamide
CID 90509900
4-amino-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 55041968
N-(2-methylpropyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide
CID 90509763
6-N-(3-methoxyphenyl)-2-N-phenylpyridine-2,6-dicarboxamide
CID 109099989
4-(3-methoxyanilino)-N-phenylpyridine-2-carboxamide
CID 109218773
2-[(3,5-dimethoxybenzoyl)amino]-N-phenyl-1,3-thiazole-4-carboxamide
CID 16915246
N-(3-methoxyphenyl)isoquinoline-3-carboxamide
CID 110859992

Frequently Asked Questions

What is the IUPAC name of N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide (CID 90509804) is N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide is COc1cccc(NC(=O)c2csc(Nc3ccccn3)n2)c1.
What is the InChIKey of N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide?
The InChIKey is NBDBIDFBSJUVOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2S/c1-22-12-6-4-5-11(9-12)18-15(21)13-10-23-16(19-13)20-14-7-2-3-8-17-14/h2-10H,1H3,(H,18,21)(H,17,19,20).
What are the key properties of N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide?
N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide has a molecular weight of 326.38 g/mol, XLogP of 3.54, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxyphenyl)-2-(pyridin-2-ylamino)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 90509804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).