2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide

C13H20N2OS — CID 64679741

IUPAC2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide
SMILESCC(NC(=O)CC1(N)CCCC1)c1ccsc1
InChIInChI=1S/C13H20N2OS/c1-10(11-4-7-17-9-11)15-12(16)8-13(14)5-2-3-6-13/h4,7,9-10H,2-3,5-6,8,14H2,1H3,(H,15,16)
InChIKeyLELXVSXQXYFTOB-UHFFFAOYSA-N
MW252.38 g/mol
LogP2.59
Rot. Bonds4

About 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide

2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide (PubChem CID 64679741) has the molecular formula C13H20N2OS and a molecular weight of 252.38 g/mol. Its IUPAC name is 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide.

Molecular Properties

Compound Name2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide
PubChem CID64679741
Molecular FormulaC13H20N2OS
Molecular Weight252.38 g/mol
Exact Mass252.13
IUPAC Name2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide
SMILESCC(NC(=O)CC1(N)CCCC1)c1ccsc1
InChIInChI=1S/C13H20N2OS/c1-10(11-4-7-17-9-11)15-12(16)8-13(14)5-2-3-6-13/h4,7,9-10H,2-3,5-6,8,14H2,1H3,(H,15,16)
InChIKeyLELXVSXQXYFTOB-UHFFFAOYSA-N
XLogP2.59
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.38
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide?
The IUPAC name of 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide (CID 64679741) is 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide.
What is the SMILES notation for 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide?
The canonical SMILES for 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide is CC(NC(=O)CC1(N)CCCC1)c1ccsc1.
What is the InChIKey of 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide?
The InChIKey is LELXVSXQXYFTOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2OS/c1-10(11-4-7-17-9-11)15-12(16)8-13(14)5-2-3-6-13/h4,7,9-10H,2-3,5-6,8,14H2,1H3,(H,15,16).
What are the key properties of 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide?
2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide has a molecular weight of 252.38 g/mol, XLogP of 2.59, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-aminocyclopentyl)-N-(1-thiophen-3-ylethyl)acetamide is sourced from PubChem (CID 64679741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).