1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one

C20H30N4O2 — CID 70726233

IUPAC1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one
SMILESO=C(C1CC(=O)N(C2CCCC2)C1)N1CCN(CCn2cccc2)CC1
InChIInChI=1S/C20H30N4O2/c25-19-15-17(16-24(19)18-5-1-2-6-18)20(26)23-13-11-22(12-14-23)10-9-21-7-3-4-8-21/h3-4,7-8,17-18H,1-2,5-6,9-16H2
InChIKeyOVJPLGKQMXWJOW-UHFFFAOYSA-N
MW358.49 g/mol
LogP1.42
Rot. Bonds5

About 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one

1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one (PubChem CID 70726233) has the molecular formula C20H30N4O2 and a molecular weight of 358.49 g/mol. Its IUPAC name is 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one.

Molecular Properties

Compound Name1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one
PubChem CID70726233
Molecular FormulaC20H30N4O2
Molecular Weight358.49 g/mol
Exact Mass358.24
IUPAC Name1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one
SMILESO=C(C1CC(=O)N(C2CCCC2)C1)N1CCN(CCn2cccc2)CC1
InChIInChI=1S/C20H30N4O2/c25-19-15-17(16-24(19)18-5-1-2-6-18)20(26)23-13-11-22(12-14-23)10-9-21-7-3-4-8-21/h3-4,7-8,17-18H,1-2,5-6,9-16H2
InChIKeyOVJPLGKQMXWJOW-UHFFFAOYSA-N
XLogP1.42
TPSA48.79 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.49
LogP ≤ 51.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The IUPAC name of 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one (CID 70726233) is 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one.
What is the SMILES notation for 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The canonical SMILES for 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one is O=C(C1CC(=O)N(C2CCCC2)C1)N1CCN(CCn2cccc2)CC1.
What is the InChIKey of 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
The InChIKey is OVJPLGKQMXWJOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H30N4O2/c25-19-15-17(16-24(19)18-5-1-2-6-18)20(26)23-13-11-22(12-14-23)10-9-21-7-3-4-8-21/h3-4,7-8,17-18H,1-2,5-6,9-16H2.
What are the key properties of 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one?
1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one has a molecular weight of 358.49 g/mol, XLogP of 1.42, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-[4-(2-pyrrol-1-ylethyl)piperazine-1-carbonyl]pyrrolidin-2-one is sourced from PubChem (CID 70726233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).