2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide

C15H21NO2S — CID 90371568

IUPAC2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide
SMILESCC(C(=O)NCC(=O)c1ccsc1)C1CCCCC1
InChIInChI=1S/C15H21NO2S/c1-11(12-5-3-2-4-6-12)15(18)16-9-14(17)13-7-8-19-10-13/h7-8,10-12H,2-6,9H2,1H3,(H,16,18)
InChIKeyPKGFFVYJRREINE-UHFFFAOYSA-N
MW279.40 g/mol
LogP3.26
Rot. Bonds5

About 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide

2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide (PubChem CID 90371568) has the molecular formula C15H21NO2S and a molecular weight of 279.40 g/mol. Its IUPAC name is 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide.

Molecular Properties

Compound Name2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide
PubChem CID90371568
Molecular FormulaC15H21NO2S
Molecular Weight279.40 g/mol
Exact Mass279.13
IUPAC Name2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide
SMILESCC(C(=O)NCC(=O)c1ccsc1)C1CCCCC1
InChIInChI=1S/C15H21NO2S/c1-11(12-5-3-2-4-6-12)15(18)16-9-14(17)13-7-8-19-10-13/h7-8,10-12H,2-6,9H2,1H3,(H,16,18)
InChIKeyPKGFFVYJRREINE-UHFFFAOYSA-N
XLogP3.26
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.40
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide 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-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide
CID 95292148
2-cyclopropyl-1-thiophen-3-ylpropan-1-one
CID 114975207
2-cyclopentyl-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]propanamide
CID 110605936
N'-[(2S)-2-cyclohexylpropanoyl]benzohydrazide
CID 90371495
N-[4-cyano-5-(cyclohexylamino)-3,5-dioxopentyl]thiophene-3-carboxamide
CID 87011948
N-(2-amino-2-cyclopropylethyl)thiophene-3-carboxamide
CID 115301128
N-(1-cyclohexylprop-2-ynyl)thiophene-3-carboxamide
CID 123668523
N-[2-(cycloheptylamino)ethyl]-2-cyclopropylpropanamide
CID 81482446
N-(2-cyclohexyl-2-hydroxyethyl)-4-thiophen-3-ylbenzamide
CID 91624535
N-butyl-2-cyclopentylpropanamide
CID 173178636
2-cycloheptyl-1-phenylpropan-1-one
CID 104844954
N,N-di(propan-2-yl)thiophene-3-carboxamide
CID 50896326

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide?
The IUPAC name of 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide (CID 90371568) is 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide.
What is the SMILES notation for 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide?
The canonical SMILES for 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide is CC(C(=O)NCC(=O)c1ccsc1)C1CCCCC1.
What is the InChIKey of 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide?
The InChIKey is PKGFFVYJRREINE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2S/c1-11(12-5-3-2-4-6-12)15(18)16-9-14(17)13-7-8-19-10-13/h7-8,10-12H,2-6,9H2,1H3,(H,16,18).
What are the key properties of 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide?
2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide has a molecular weight of 279.40 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide is sourced from PubChem (CID 90371568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).