3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide

C15H23NO2S — CID 111452313

IUPAC3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide
SMILESCC(O)(CNC(=O)CCC1CCCC1)c1ccsc1
InChIInChI=1S/C15H23NO2S/c1-15(18,13-8-9-19-10-13)11-16-14(17)7-6-12-4-2-3-5-12/h8-10,12,18H,2-7,11H2,1H3,(H,16,17)
InChIKeyJUXQUAHAMLQYOC-UHFFFAOYSA-N
MW281.42 g/mol
LogP3.04
Rot. Bonds6

About 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide

3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide (PubChem CID 111452313) has the molecular formula C15H23NO2S and a molecular weight of 281.42 g/mol. Its IUPAC name is 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide.

Molecular Properties

Compound Name3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide
PubChem CID111452313
Molecular FormulaC15H23NO2S
Molecular Weight281.42 g/mol
Exact Mass281.14
IUPAC Name3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide
SMILESCC(O)(CNC(=O)CCC1CCCC1)c1ccsc1
InChIInChI=1S/C15H23NO2S/c1-15(18,13-8-9-19-10-13)11-16-14(17)7-6-12-4-2-3-5-12/h8-10,12,18H,2-7,11H2,1H3,(H,16,17)
InChIKeyJUXQUAHAMLQYOC-UHFFFAOYSA-N
XLogP3.04
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.42
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N'-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)butanediamide
CID 109477004
1-(cyclopentylmethylamino)-2-thiophen-3-ylpropan-2-ol
CID 115907531
3-cyclohexyl-N-(2-hydroxy-2-thiophen-2-yl-2-thiophen-3-ylethyl)propanamide
CID 121170042
N-(2-hydroxy-2-thiophen-3-ylpropyl)-3,3-dimethylbutanamide
CID 111452236
N-(2-hydroxy-2-thiophen-3-ylpropyl)-2,2-dimethylpropanamide
CID 111452293
3-(4-fluorophenyl)sulfanyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide
CID 111519812
N-(2-hydroxy-2-thiophen-3-ylpropyl)-3-(2-methylpropoxy)propanamide
CID 111451949
4-(4-fluorophenyl)-N-(2-hydroxy-2-thiophen-3-ylpropyl)-4-oxobutanamide
CID 111452217
N-(2-amino-2-methylpropyl)-3-cyclopentylpropanamide
CID 81425234
N-(2-hydroxy-2-thiophen-3-ylpropyl)-5-phenylpent-4-enamide
CID 111451822
3-(3,4-difluorophenyl)-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide
CID 111452290
N-cyclohexyl-2-[[ethylamino-[(2-hydroxy-2-thiophen-3-ylpropyl)amino]methylidene]amino]acetamide
CID 111654054

Frequently Asked Questions

What is the IUPAC name of 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide?
The IUPAC name of 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide (CID 111452313) is 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide.
What is the SMILES notation for 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide?
The canonical SMILES for 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide is CC(O)(CNC(=O)CCC1CCCC1)c1ccsc1.
What is the InChIKey of 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide?
The InChIKey is JUXQUAHAMLQYOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23NO2S/c1-15(18,13-8-9-19-10-13)11-16-14(17)7-6-12-4-2-3-5-12/h8-10,12,18H,2-7,11H2,1H3,(H,16,17).
What are the key properties of 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide?
3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide has a molecular weight of 281.42 g/mol, XLogP of 3.04, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopentyl-N-(2-hydroxy-2-thiophen-3-ylpropyl)propanamide is sourced from PubChem (CID 111452313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).