2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide

C17H15N3O2S — CID 675361

IUPAC2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2sc(N)nc2-c2ccccc2)cc1
InChIInChI=1S/C17H15N3O2S/c1-22-13-9-7-12(8-10-13)19-16(21)15-14(20-17(18)23-15)11-5-3-2-4-6-11/h2-10H,1H3,(H2,18,20)(H,19,21)
InChIKeyUYQYKFCAEVZZCW-UHFFFAOYSA-N
MW325.39 g/mol
LogP3.65
Rot. Bonds4

About 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide

2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide (PubChem CID 675361) has the molecular formula C17H15N3O2S and a molecular weight of 325.39 g/mol. Its IUPAC name is 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide
PubChem CID675361
Molecular FormulaC17H15N3O2S
Molecular Weight325.39 g/mol
Exact Mass325.09
IUPAC Name2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide
SMILESCOc1ccc(NC(=O)c2sc(N)nc2-c2ccccc2)cc1
InChIInChI=1S/C17H15N3O2S/c1-22-13-9-7-12(8-10-13)19-16(21)15-14(20-17(18)23-15)11-5-3-2-4-6-11/h2-10H,1H3,(H2,18,20)(H,19,21)
InChIKeyUYQYKFCAEVZZCW-UHFFFAOYSA-N
XLogP3.65
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.39
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide?
The IUPAC name of 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide (CID 675361) is 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide.
What is the SMILES notation for 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide?
The canonical SMILES for 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide is COc1ccc(NC(=O)c2sc(N)nc2-c2ccccc2)cc1.
What is the InChIKey of 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide?
The InChIKey is UYQYKFCAEVZZCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2S/c1-22-13-9-7-12(8-10-13)19-16(21)15-14(20-17(18)23-15)11-5-3-2-4-6-11/h2-10H,1H3,(H2,18,20)(H,19,21).
What are the key properties of 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide?
2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide has a molecular weight of 325.39 g/mol, XLogP of 3.65, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-methoxyphenyl)-4-phenyl-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 675361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).