1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide

C15H20N2O2S — CID 3245544

IUPAC1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide
SMILESO=C(NCc1cccs1)C1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C15H20N2O2S/c18-14-8-11(10-17(14)12-4-1-2-5-12)15(19)16-9-13-6-3-7-20-13/h3,6-7,11-12H,1-2,4-5,8-10H2,(H,16,19)
InChIKeyMHRURPBGRXPCDP-UHFFFAOYSA-N
MW292.40 g/mol
LogP2.16
Rot. Bonds4

About 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide

1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide (PubChem CID 3245544) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide
PubChem CID3245544
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide
SMILESO=C(NCc1cccs1)C1CC(=O)N(C2CCCC2)C1
InChIInChI=1S/C15H20N2O2S/c18-14-8-11(10-17(14)12-4-1-2-5-12)15(19)16-9-13-6-3-7-20-13/h3,6-7,11-12H,1-2,4-5,8-10H2,(H,16,19)
InChIKeyMHRURPBGRXPCDP-UHFFFAOYSA-N
XLogP2.16
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide?
The IUPAC name of 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide (CID 3245544) is 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide is O=C(NCc1cccs1)C1CC(=O)N(C2CCCC2)C1.
What is the InChIKey of 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide?
The InChIKey is MHRURPBGRXPCDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c18-14-8-11(10-17(14)12-4-1-2-5-12)15(19)16-9-13-6-3-7-20-13/h3,6-7,11-12H,1-2,4-5,8-10H2,(H,16,19).
What are the key properties of 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide?
1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide has a molecular weight of 292.40 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-5-oxo-N-(thiophen-2-ylmethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 3245544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).