2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide

C18H17N3O2S — CID 22170733

IUPAC2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCC(C)c1cnc(NC(=O)c2cccnc2Oc2ccccc2)s1
InChIInChI=1S/C18H17N3O2S/c1-12(2)15-11-20-18(24-15)21-16(22)14-9-6-10-19-17(14)23-13-7-4-3-5-8-13/h3-12H,1-2H3,(H,20,21,22)
InChIKeyUMGNBGCMMDFBOA-UHFFFAOYSA-N
MW339.42 g/mol
LogP4.71
Rot. Bonds5

About 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide

2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide (PubChem CID 22170733) has the molecular formula C18H17N3O2S and a molecular weight of 339.42 g/mol. Its IUPAC name is 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
PubChem CID22170733
Molecular FormulaC18H17N3O2S
Molecular Weight339.42 g/mol
Exact Mass339.10
IUPAC Name2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide
SMILESCC(C)c1cnc(NC(=O)c2cccnc2Oc2ccccc2)s1
InChIInChI=1S/C18H17N3O2S/c1-12(2)15-11-20-18(24-15)21-16(22)14-9-6-10-19-17(14)23-13-7-4-3-5-8-13/h3-12H,1-2H3,(H,20,21,22)
InChIKeyUMGNBGCMMDFBOA-UHFFFAOYSA-N
XLogP4.71
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-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

methyl 2-[(5-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]benzoate
CID 22170596
N-(5-butyl-1,3,4-thiadiazol-2-yl)-2-phenoxypyridine-3-carboxamide
CID 24648214
4-[(5-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]benzoic acid
CID 87952464
N-(4-methoxyphenyl)-2-phenoxypyridine-3-carboxamide
CID 24513637
N-(3-methylbutyl)-2-phenoxypyridine-3-carboxamide
CID 24512570
2-methoxy-N-(5-methyl-1,3-thiazol-2-yl)pyridine-3-carboxamide
CID 46557890
N-(3-methylphenyl)-2-phenoxypyridine-3-carboxamide
CID 24513585
N-[4-[4-(1-acetamidoethyl)phenyl]-1,3-thiazol-2-yl]-2-phenoxypyridine-3-carboxamide
CID 55434069
methyl 4-[(5-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]benzoate
CID 22170458
2-[[2-(3-bromophenoxy)pyridine-3-carbonyl]amino]-1,3-thiazole-5-carboxamide
CID 78884843
ethyl 2-[(2-phenoxypyridine-3-carbonyl)amino]-1,3-thiazole-4-carboxylate
CID 55354839
4-ethoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)benzamide
CID 22170489

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The IUPAC name of 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide (CID 22170733) is 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide.
What is the SMILES notation for 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The canonical SMILES for 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide is CC(C)c1cnc(NC(=O)c2cccnc2Oc2ccccc2)s1.
What is the InChIKey of 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
The InChIKey is UMGNBGCMMDFBOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2S/c1-12(2)15-11-20-18(24-15)21-16(22)14-9-6-10-19-17(14)23-13-7-4-3-5-8-13/h3-12H,1-2H3,(H,20,21,22).
What are the key properties of 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide?
2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide has a molecular weight of 339.42 g/mol, XLogP of 4.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(5-propan-2-yl-1,3-thiazol-2-yl)pyridine-3-carboxamide is sourced from PubChem (CID 22170733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).