1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one

C16H24N2O2 — CID 127283613

IUPAC1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one
SMILESC=C1CCN(C(=O)C2CC(=O)N(C3CCCC3)C2)CC1
InChIInChI=1S/C16H24N2O2/c1-12-6-8-17(9-7-12)16(20)13-10-15(19)18(11-13)14-4-2-3-5-14/h13-14H,1-11H2
InChIKeyWLGZVWVBHYFKEM-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.96
Rot. Bonds2

About 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one

1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one (PubChem CID 127283613) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one.

Molecular Properties

Compound Name1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one
PubChem CID127283613
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one
SMILESC=C1CCN(C(=O)C2CC(=O)N(C3CCCC3)C2)CC1
InChIInChI=1S/C16H24N2O2/c1-12-6-8-17(9-7-12)16(20)13-10-15(19)18(11-13)14-4-2-3-5-14/h13-14H,1-11H2
InChIKeyWLGZVWVBHYFKEM-UHFFFAOYSA-N
XLogP1.96
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one?
The IUPAC name of 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one (CID 127283613) is 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one.
What is the SMILES notation for 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one?
The canonical SMILES for 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one is C=C1CCN(C(=O)C2CC(=O)N(C3CCCC3)C2)CC1.
What is the InChIKey of 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one?
The InChIKey is WLGZVWVBHYFKEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-12-6-8-17(9-7-12)16(20)13-10-15(19)18(11-13)14-4-2-3-5-14/h13-14H,1-11H2.
What are the key properties of 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one?
1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one has a molecular weight of 276.38 g/mol, XLogP of 1.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-4-(4-methylidenepiperidine-1-carbonyl)pyrrolidin-2-one is sourced from PubChem (CID 127283613), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).