1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one

C14H22N2O — CID 81334184

IUPAC1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one
SMILESCC(NCCn1ccccc1=O)C1CCCC1
InChIInChI=1S/C14H22N2O/c1-12(13-6-2-3-7-13)15-9-11-16-10-5-4-8-14(16)17/h4-5,8,10,12-13,15H,2-3,6-7,9,11H2,1H3
InChIKeyMMXYOWJZHOGKTK-UHFFFAOYSA-N
MW234.34 g/mol
LogP2.02
Rot. Bonds5

About 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one

1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one (PubChem CID 81334184) has the molecular formula C14H22N2O and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one.

Molecular Properties

Compound Name1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one
PubChem CID81334184
Molecular FormulaC14H22N2O
Molecular Weight234.34 g/mol
Exact Mass234.17
IUPAC Name1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one
SMILESCC(NCCn1ccccc1=O)C1CCCC1
InChIInChI=1S/C14H22N2O/c1-12(13-6-2-3-7-13)15-9-11-16-10-5-4-8-14(16)17/h4-5,8,10,12-13,15H,2-3,6-7,9,11H2,1H3
InChIKeyMMXYOWJZHOGKTK-UHFFFAOYSA-N
XLogP2.02
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one?
The IUPAC name of 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one (CID 81334184) is 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one.
What is the SMILES notation for 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one?
The canonical SMILES for 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one is CC(NCCn1ccccc1=O)C1CCCC1.
What is the InChIKey of 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one?
The InChIKey is MMXYOWJZHOGKTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O/c1-12(13-6-2-3-7-13)15-9-11-16-10-5-4-8-14(16)17/h4-5,8,10,12-13,15H,2-3,6-7,9,11H2,1H3.
What are the key properties of 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one?
1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one has a molecular weight of 234.34 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-cyclopentylethylamino)ethyl]pyridin-2-one is sourced from PubChem (CID 81334184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).