N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide

C11H18N2O2 — CID 142438420

IUPACN-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide
SMILESCC1CNC(=O)C1C(=O)NC1CCCC1
InChIInChI=1S/C11H18N2O2/c1-7-6-12-10(14)9(7)11(15)13-8-4-2-3-5-8/h7-9H,2-6H2,1H3,(H,12,14)(H,13,15)
InChIKeyCQPNPMSKBMKTFL-UHFFFAOYSA-N
MW210.28 g/mol
LogP0.43
Rot. Bonds2

About N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide

N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide (PubChem CID 142438420) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide
PubChem CID142438420
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC NameN-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide
SMILESCC1CNC(=O)C1C(=O)NC1CCCC1
InChIInChI=1S/C11H18N2O2/c1-7-6-12-10(14)9(7)11(15)13-8-4-2-3-5-8/h7-9H,2-6H2,1H3,(H,12,14)(H,13,15)
InChIKeyCQPNPMSKBMKTFL-UHFFFAOYSA-N
XLogP0.43
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 50.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide?
The IUPAC name of N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide (CID 142438420) is N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide?
The canonical SMILES for N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide is CC1CNC(=O)C1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide?
The InChIKey is CQPNPMSKBMKTFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-7-6-12-10(14)9(7)11(15)13-8-4-2-3-5-8/h7-9H,2-6H2,1H3,(H,12,14)(H,13,15).
What are the key properties of N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide?
N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide has a molecular weight of 210.28 g/mol, XLogP of 0.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-methyl-2-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 142438420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).