N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide

C21H34N4O3 — CID 134799365

IUPACN-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC(C(=O)N2CCC(N3CCCC3=O)CC2)CC1
InChIInChI=1S/C21H34N4O3/c26-19-6-3-11-25(19)18-9-14-23(15-10-18)20(27)16-7-12-24(13-8-16)21(28)22-17-4-1-2-5-17/h16-18H,1-15H2,(H,22,28)
InChIKeyHCCWQLNOOWGEFL-UHFFFAOYSA-N
MW390.53 g/mol
LogP1.96
Rot. Bonds3

About N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide

N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide (PubChem CID 134799365) has the molecular formula C21H34N4O3 and a molecular weight of 390.53 g/mol. Its IUPAC name is N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide
PubChem CID134799365
Molecular FormulaC21H34N4O3
Molecular Weight390.53 g/mol
Exact Mass390.26
IUPAC NameN-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide
SMILESO=C(NC1CCCC1)N1CCC(C(=O)N2CCC(N3CCCC3=O)CC2)CC1
InChIInChI=1S/C21H34N4O3/c26-19-6-3-11-25(19)18-9-14-23(15-10-18)20(27)16-7-12-24(13-8-16)21(28)22-17-4-1-2-5-17/h16-18H,1-15H2,(H,22,28)
InChIKeyHCCWQLNOOWGEFL-UHFFFAOYSA-N
XLogP1.96
TPSA72.96 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.53
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide (CID 134799365) is N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide is O=C(NC1CCCC1)N1CCC(C(=O)N2CCC(N3CCCC3=O)CC2)CC1.
What is the InChIKey of N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide?
The InChIKey is HCCWQLNOOWGEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H34N4O3/c26-19-6-3-11-25(19)18-9-14-23(15-10-18)20(27)16-7-12-24(13-8-16)21(28)22-17-4-1-2-5-17/h16-18H,1-15H2,(H,22,28).
What are the key properties of N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide?
N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide has a molecular weight of 390.53 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[4-(2-oxopyrrolidin-1-yl)piperidine-1-carbonyl]piperidine-1-carboxamide is sourced from PubChem (CID 134799365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).