N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide

C13H19NO2S — CID 95292148

IUPACN-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide
SMILESO=C(NC[C@@H](O)C1CCCCC1)c1ccsc1
InChIInChI=1S/C13H19NO2S/c15-12(10-4-2-1-3-5-10)8-14-13(16)11-6-7-17-9-11/h6-7,9-10,12,15H,1-5,8H2,(H,14,16)/t12-/m1/s1
InChIKeyOWUQPIGRTOPKIY-GFCCVEGCSA-N
MW253.37 g/mol
LogP2.42
Rot. Bonds4

About N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide

N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide (PubChem CID 95292148) has the molecular formula C13H19NO2S and a molecular weight of 253.37 g/mol. Its IUPAC name is N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide
PubChem CID95292148
Molecular FormulaC13H19NO2S
Molecular Weight253.37 g/mol
Exact Mass253.11
IUPAC NameN-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide
SMILESO=C(NC[C@@H](O)C1CCCCC1)c1ccsc1
InChIInChI=1S/C13H19NO2S/c15-12(10-4-2-1-3-5-10)8-14-13(16)11-6-7-17-9-11/h6-7,9-10,12,15H,1-5,8H2,(H,14,16)/t12-/m1/s1
InChIKeyOWUQPIGRTOPKIY-GFCCVEGCSA-N
XLogP2.42
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-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

N-(2-cyclohexyl-2-hydroxyethyl)-4-thiophen-3-ylbenzamide
CID 91624535
N-(2-amino-2-cyclopropylethyl)thiophene-3-carboxamide
CID 115301128
4-bromo-N-[(2R)-2-cyclohexyl-2-hydroxyethyl]benzamide
CID 95292167
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-4-phenylbenzamide
CID 95367502
N-(2-cyclopentyl-2-hydroxyethyl)furan-3-carboxamide
CID 111426324
N-(2-cyclohexyl-2-hydroxyethyl)-4-propylbenzamide
CID 90498765
3-N-[(2S)-2-cyclohexyl-2-hydroxyethyl]-1-N-methylbenzene-1,3-dicarboxamide
CID 97218721
2-cyclohexyl-N-(2-oxo-2-thiophen-3-ylethyl)propanamide
CID 90371568
N-(2-cyclopentyl-2-hydroxyethyl)-3-methylbenzamide
CID 111425752
N-(2-cyclohexyl-2-hydroxyethyl)-3,5-dimethoxybenzamide
CID 90498790
3-bromo-N-(2-cyclopentyl-2-hydroxyethyl)thiophene-2-carboxamide
CID 111426282
N-(1-cyclohexylprop-2-ynyl)thiophene-3-carboxamide
CID 123668523

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide?
The IUPAC name of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide (CID 95292148) is N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide?
The canonical SMILES for N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide is O=C(NC[C@@H](O)C1CCCCC1)c1ccsc1.
What is the InChIKey of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide?
The InChIKey is OWUQPIGRTOPKIY-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H19NO2S/c15-12(10-4-2-1-3-5-10)8-14-13(16)11-6-7-17-9-11/h6-7,9-10,12,15H,1-5,8H2,(H,14,16)/t12-/m1/s1.
What are the key properties of N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide?
N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-2-cyclohexyl-2-hydroxyethyl]thiophene-3-carboxamide is sourced from PubChem (CID 95292148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).