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

C14H17N3O2S — CID 52906119

IUPAC4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide
SMILESCCCNC(=O)c1snc(-c2ccc(OC)cc2)c1N
InChIInChI=1S/C14H17N3O2S/c1-3-8-16-14(18)13-11(15)12(17-20-13)9-4-6-10(19-2)7-5-9/h4-7H,3,8,15H2,1-2H3,(H,16,18)
InChIKeySXDGFTSHRAHUHY-UHFFFAOYSA-N
MW291.38 g/mol
LogP2.54
Rot. Bonds5

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

4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide (PubChem CID 52906119) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide.

Molecular Properties

Compound Name4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide
PubChem CID52906119
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide
SMILESCCCNC(=O)c1snc(-c2ccc(OC)cc2)c1N
InChIInChI=1S/C14H17N3O2S/c1-3-8-16-14(18)13-11(15)12(17-20-13)9-4-6-10(19-2)7-5-9/h4-7H,3,8,15H2,1-2H3,(H,16,18)
InChIKeySXDGFTSHRAHUHY-UHFFFAOYSA-N
XLogP2.54
TPSA77.24 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-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

Related Compounds

4-amino-N-butyl-3-(4-methoxyphenyl)-1,2-thiazole-5-carboxamide
CID 52906123
4-amino-3-(4-fluorophenyl)-N-(2-methylpropyl)-1,2-thiazole-5-carboxamide
CID 53335719
2-amino-5-(4-methoxyphenyl)-4-methyl-N-propylthiophene-3-carboxamide
CID 63273246
4-amino-3-(4-methylphenyl)-N-(pyridin-4-ylmethyl)-1,2-thiazole-5-carboxamide
CID 52906101
methyl 4-amino-3-(4-fluorophenyl)-1,2-thiazole-5-carboxylate
CID 13073191
4-amino-N-[(2-fluorophenyl)methyl]-3-(3-methoxyphenyl)-1,2-thiazole-5-carboxamide
CID 53335741
4-amino-3-(4-methylphenyl)-N-(pyridin-2-ylmethyl)-1,2-thiazole-5-carboxamide
CID 52906086
4-amino-3-phenyl-N-(2-thiophen-2-ylethyl)-1,2-thiazole-5-carboxamide
CID 53335695
2-amino-5-methoxy-N-propylbenzamide
CID 60954595
ethyl 3-(4-acetamidophenyl)-4-amino-1,2-thiazole-5-carboxylate
CID 134095187
4-amino-N-[(1R)-2-(cyclohexylamino)-1-(4-methoxyphenyl)-2-oxoethyl]-N-(2-methoxyethyl)-3-(4-methoxyphenyl)-1,2-thiazole-5-carboxamide
CID 98099556
[4-amino-3-(4-methoxyphenyl)-1,2-thiazol-5-yl]-(4-phenylpiperazin-1-yl)methanone
CID 52906138

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide?
The IUPAC name of 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide (CID 52906119) is 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide.
What is the SMILES notation for 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide?
The canonical SMILES for 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide is CCCNC(=O)c1snc(-c2ccc(OC)cc2)c1N.
What is the InChIKey of 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide?
The InChIKey is SXDGFTSHRAHUHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-3-8-16-14(18)13-11(15)12(17-20-13)9-4-6-10(19-2)7-5-9/h4-7H,3,8,15H2,1-2H3,(H,16,18).
What are the key properties of 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide?
4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide has a molecular weight of 291.38 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-3-(4-methoxyphenyl)-N-propyl-1,2-thiazole-5-carboxamide is sourced from PubChem (CID 52906119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).