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

C14H21NO2S — CID 71787790

IUPAC2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide
SMILESO=C(CC1CCCC1)NCCC(O)c1cccs1
InChIInChI=1S/C14H21NO2S/c16-12(13-6-3-9-18-13)7-8-15-14(17)10-11-4-1-2-5-11/h3,6,9,11-12,16H,1-2,4-5,7-8,10H2,(H,15,17)
InChIKeyDSWZWWNGWYPLCD-UHFFFAOYSA-N
MW267.39 g/mol
LogP2.87
Rot. Bonds6

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

2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide (PubChem CID 71787790) has the molecular formula C14H21NO2S and a molecular weight of 267.39 g/mol. Its IUPAC name is 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide.

Molecular Properties

Compound Name2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide
PubChem CID71787790
Molecular FormulaC14H21NO2S
Molecular Weight267.39 g/mol
Exact Mass267.13
IUPAC Name2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide
SMILESO=C(CC1CCCC1)NCCC(O)c1cccs1
InChIInChI=1S/C14H21NO2S/c16-12(13-6-3-9-18-13)7-8-15-14(17)10-11-4-1-2-5-11/h3,6,9,11-12,16H,1-2,4-5,7-8,10H2,(H,15,17)
InChIKeyDSWZWWNGWYPLCD-UHFFFAOYSA-N
XLogP2.87
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.39
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide?
The IUPAC name of 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide (CID 71787790) is 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide.
What is the SMILES notation for 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide?
The canonical SMILES for 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide is O=C(CC1CCCC1)NCCC(O)c1cccs1.
What is the InChIKey of 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide?
The InChIKey is DSWZWWNGWYPLCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2S/c16-12(13-6-3-9-18-13)7-8-15-14(17)10-11-4-1-2-5-11/h3,6,9,11-12,16H,1-2,4-5,7-8,10H2,(H,15,17).
What are the key properties of 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide?
2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide has a molecular weight of 267.39 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-N-(3-hydroxy-3-thiophen-2-ylpropyl)acetamide is sourced from PubChem (CID 71787790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).