2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide

C17H21N3OS — CID 856357

IUPAC2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
SMILESO=C(CNC1CCCCC1)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H21N3OS/c21-16(11-18-14-9-5-2-6-10-14)20-17-19-15(12-22-17)13-7-3-1-4-8-13/h1,3-4,7-8,12,14,18H,2,5-6,9-11H2,(H,19,20,21)
InChIKeyQSPFPWBSVQBMJF-UHFFFAOYSA-N
MW315.44 g/mol
LogP3.67
Rot. Bonds5

About 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide

2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide (PubChem CID 856357) has the molecular formula C17H21N3OS and a molecular weight of 315.44 g/mol. Its IUPAC name is 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide.

Molecular Properties

Compound Name2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
PubChem CID856357
Molecular FormulaC17H21N3OS
Molecular Weight315.44 g/mol
Exact Mass315.14
IUPAC Name2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
SMILESO=C(CNC1CCCCC1)Nc1nc(-c2ccccc2)cs1
InChIInChI=1S/C17H21N3OS/c21-16(11-18-14-9-5-2-6-10-14)20-17-19-15(12-22-17)13-7-3-1-4-8-13/h1,3-4,7-8,12,14,18H,2,5-6,9-11H2,(H,19,20,21)
InChIKeyQSPFPWBSVQBMJF-UHFFFAOYSA-N
XLogP3.67
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.44
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide 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-(4-phenyl-1,3-thiazol-2-yl)cyclopentanecarboxamide
CID 2163654
[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl] 2-cyclopentylacetate
CID 2340359
2-cyclohexyloxy-N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]acetamide
CID 167863923
2-(2-methylpiperidin-1-ium-1-yl)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
CID 3455286
4-oxo-4-[(4-phenyl-1,3-thiazol-2-yl)amino]butanoic acid
CID 804919
methyl N-[2-oxo-2-[(4-phenyl-1,3-thiazol-2-yl)amino]ethyl]carbamate
CID 47299409
2-(cyclopentylamino)-N-(4-propan-2-yl-1,3-thiazol-2-yl)acetamide
CID 54958579
2-[2-(2-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
CID 3685808
cis-(1S,2R)-2-[[4-(4-phenylphenyl)-1,3-thiazol-2-yl]carbamoyl]cyclohexane-1-carboxylic acid
CID 1000957
1,3-bis(4-phenyl-1,3-thiazol-2-yl)urea
CID 13089293
2-[(2E)-2-benzylidenehydrazinyl]-N-(4-phenyl-1,3-thiazol-2-yl)acetamide
CID 24865723
3-phenyl-N-(4-phenyl-1,3-thiazol-2-yl)propanamide
CID 840341

Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide?
The IUPAC name of 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide (CID 856357) is 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide.
What is the SMILES notation for 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide?
The canonical SMILES for 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide is O=C(CNC1CCCCC1)Nc1nc(-c2ccccc2)cs1.
What is the InChIKey of 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide?
The InChIKey is QSPFPWBSVQBMJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21N3OS/c21-16(11-18-14-9-5-2-6-10-14)20-17-19-15(12-22-17)13-7-3-1-4-8-13/h1,3-4,7-8,12,14,18H,2,5-6,9-11H2,(H,19,20,21).
What are the key properties of 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide?
2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide has a molecular weight of 315.44 g/mol, XLogP of 3.67, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexylamino)-N-(4-phenyl-1,3-thiazol-2-yl)acetamide is sourced from PubChem (CID 856357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).