N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide

C13H19NO2S — CID 71782111

IUPACN-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide
SMILESO=C(NCC(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)
InChIKeyOWUQPIGRTOPKIY-UHFFFAOYSA-N
MW253.37 g/mol
LogP2.42
Rot. Bonds4

About N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide

N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide (PubChem CID 71782111) has the molecular formula C13H19NO2S and a molecular weight of 253.37 g/mol. Its IUPAC name is N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide
PubChem CID71782111
Molecular FormulaC13H19NO2S
Molecular Weight253.37 g/mol
Exact Mass253.11
IUPAC NameN-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide
SMILESO=C(NCC(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)
InChIKeyOWUQPIGRTOPKIY-UHFFFAOYSA-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-(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-[12-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]dodecyl]thiophene-3-carboxamide
CID 171471405
N-[(1-hydroxycyclopentyl)methyl]thiophene-3-carboxamide
CID 49670540
N-(2-cyclohexyl-2-hydroxyethyl)thiophene-2-carboxamide
CID 56764280
N-[(S)-3-cyclopropyl-3-hydroxypropyl]-3-thenamide
CID 96349827
N-[(4-hydroxy-8-oxaspiro[4.5]decan-3-yl)methyl]thiophene-3-carboxamide
CID 121543625
N-(cyclohexylmethyl)thiophene-3-carboxamide
CID 6734159
N-[4-[[1-hydroxy-3-(trifluoromethyl)cyclohexyl]methylamino]-4-oxobutyl]thiophene-3-carboxamide
CID 86803349
N-[4-[[(1S,3S)-1-hydroxy-3-(trifluoromethyl)cyclohexyl]methylamino]-4-oxobutyl]thiophene-3-carboxamide
CID 99788792
N-[4-[[(1R,3S)-1-hydroxy-3-(trifluoromethyl)cyclohexyl]methylamino]-4-oxobutyl]thiophene-3-carboxamide
CID 99788793
N-[4-[[(1S,3R)-1-hydroxy-3-(trifluoromethyl)cyclohexyl]methylamino]-4-oxobutyl]thiophene-3-carboxamide
CID 99788794
N-[4-[[(1R,3R)-1-hydroxy-3-(trifluoromethyl)cyclohexyl]methylamino]-4-oxobutyl]thiophene-3-carboxamide
CID 99788795
2-(Cyclohexylmethyl)-4-(3-thienylcarbonyl)morpholine
CID 45231421

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide?
The IUPAC name of N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide (CID 71782111) is N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide.
What is the SMILES notation for N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide?
The canonical SMILES for N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide is O=C(NCC(O)C1CCCCC1)c1ccsc1.
What is the InChIKey of N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide?
The InChIKey is OWUQPIGRTOPKIY-UHFFFAOYSA-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).
What are the key properties of N-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide?
N-(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-(2-cyclohexyl-2-hydroxyethyl)thiophene-3-carboxamide is sourced from PubChem (CID 71782111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).