2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one

C16H29N3O — CID 83245102

IUPAC2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one
SMILESCCN1CCCC(N2C(=O)C(C)NC2C2CCCC2)C1
InChIInChI=1S/C16H29N3O/c1-3-18-10-6-9-14(11-18)19-15(13-7-4-5-8-13)17-12(2)16(19)20/h12-15,17H,3-11H2,1-2H3
InChIKeyUKFYBJWHRYJFKD-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.81
Rot. Bonds3

About 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one

2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one (PubChem CID 83245102) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one
PubChem CID83245102
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC Name2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one
SMILESCCN1CCCC(N2C(=O)C(C)NC2C2CCCC2)C1
InChIInChI=1S/C16H29N3O/c1-3-18-10-6-9-14(11-18)19-15(13-7-4-5-8-13)17-12(2)16(19)20/h12-15,17H,3-11H2,1-2H3
InChIKeyUKFYBJWHRYJFKD-UHFFFAOYSA-N
XLogP1.81
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one?
The IUPAC name of 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one (CID 83245102) is 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one.
What is the SMILES notation for 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one?
The canonical SMILES for 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one is CCN1CCCC(N2C(=O)C(C)NC2C2CCCC2)C1.
What is the InChIKey of 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one?
The InChIKey is UKFYBJWHRYJFKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-3-18-10-6-9-14(11-18)19-15(13-7-4-5-8-13)17-12(2)16(19)20/h12-15,17H,3-11H2,1-2H3.
What are the key properties of 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one?
2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one has a molecular weight of 279.43 g/mol, XLogP of 1.81, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-3-(1-ethylpiperidin-3-yl)-5-methylimidazolidin-4-one is sourced from PubChem (CID 83245102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).