3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one

C13H24N2O — CID 79642708

IUPAC3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one
SMILESCCN1CCCC1CN(C)C1CCC(=O)C1
InChIInChI=1S/C13H24N2O/c1-3-15-8-4-5-12(15)10-14(2)11-6-7-13(16)9-11/h11-12H,3-10H2,1-2H3
InChIKeyNEDPEZDALPHTSM-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.52
Rot. Bonds4

About 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one

3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one (PubChem CID 79642708) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one.

Molecular Properties

Compound Name3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one
PubChem CID79642708
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one
SMILESCCN1CCCC1CN(C)C1CCC(=O)C1
InChIInChI=1S/C13H24N2O/c1-3-15-8-4-5-12(15)10-14(2)11-6-7-13(16)9-11/h11-12H,3-10H2,1-2H3
InChIKeyNEDPEZDALPHTSM-UHFFFAOYSA-N
XLogP1.52
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one
CID 79319987
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpiperidin-4-amine
CID 79313995
3-[2-[(dimethylamino)methyl]pyrrolidin-1-yl]cyclopentan-1-one
CID 79642697
2-[[(1-ethylpyrrolidin-2-yl)methyl-methylamino]methyl]benzoic acid
CID 79319788
4-ethyl-2-[[(1-ethylpyrrolidin-2-yl)methyl-methylamino]methyl]cyclohexan-1-one
CID 79312395
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methyl-5-oxopyrrolidine-3-carboxamide
CID 79465871
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylbenzenesulfonamide
CID 79313037
(1S)-1-[4-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]phenyl]ethanol
CID 79319186
N-[(1-ethylpyrrolidin-2-yl)methyl]-N,2,2-trimethylpropanamide
CID 79312453
N-[(1-ethylpyrrolidin-2-yl)methyl]-N-methylpyrrolidine-1-carboxamide
CID 113248160
5-[[(1-ethylpyrrolidin-2-yl)methyl-methylamino]methyl]thiophene-2-carboxylic acid
CID 79319599
5-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]thiophene-2-carbaldehyde
CID 79313530

Frequently Asked Questions

What is the IUPAC name of 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one?
The IUPAC name of 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one (CID 79642708) is 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one.
What is the SMILES notation for 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one?
The canonical SMILES for 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one is CCN1CCCC1CN(C)C1CCC(=O)C1.
What is the InChIKey of 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one?
The InChIKey is NEDPEZDALPHTSM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-3-15-8-4-5-12(15)10-14(2)11-6-7-13(16)9-11/h11-12H,3-10H2,1-2H3.
What are the key properties of 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one?
3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one has a molecular weight of 224.35 g/mol, XLogP of 1.52, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1-ethylpyrrolidin-2-yl)methyl-methylamino]cyclopentan-1-one is sourced from PubChem (CID 79642708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).