1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide

C20H27N3O2 — CID 71912128

IUPAC1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide
SMILESO=C(Nc1cccc(N2CCCC2=O)c1)C1CCCN1C1CCCC1
InChIInChI=1S/C20H27N3O2/c24-19-11-5-13-23(19)17-9-3-6-15(14-17)21-20(25)18-10-4-12-22(18)16-7-1-2-8-16/h3,6,9,14,16,18H,1-2,4-5,7-8,10-13H2,(H,21,25)
InChIKeyFPSWCKSOKJGHHE-UHFFFAOYSA-N
MW341.45 g/mol
LogP3.16
Rot. Bonds4

About 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide

1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide (PubChem CID 71912128) has the molecular formula C20H27N3O2 and a molecular weight of 341.45 g/mol. Its IUPAC name is 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide
PubChem CID71912128
Molecular FormulaC20H27N3O2
Molecular Weight341.45 g/mol
Exact Mass341.21
IUPAC Name1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide
SMILESO=C(Nc1cccc(N2CCCC2=O)c1)C1CCCN1C1CCCC1
InChIInChI=1S/C20H27N3O2/c24-19-11-5-13-23(19)17-9-3-6-15(14-17)21-20(25)18-10-4-12-22(18)16-7-1-2-8-16/h3,6,9,14,16,18H,1-2,4-5,7-8,10-13H2,(H,21,25)
InChIKeyFPSWCKSOKJGHHE-UHFFFAOYSA-N
XLogP3.16
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.45
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide?
The IUPAC name of 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide (CID 71912128) is 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide?
The canonical SMILES for 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide is O=C(Nc1cccc(N2CCCC2=O)c1)C1CCCN1C1CCCC1.
What is the InChIKey of 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide?
The InChIKey is FPSWCKSOKJGHHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H27N3O2/c24-19-11-5-13-23(19)17-9-3-6-15(14-17)21-20(25)18-10-4-12-22(18)16-7-1-2-8-16/h3,6,9,14,16,18H,1-2,4-5,7-8,10-13H2,(H,21,25).
What are the key properties of 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide?
1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide has a molecular weight of 341.45 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-N-[3-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-2-carboxamide is sourced from PubChem (CID 71912128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).