1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one

C11H21NO — CID 127370172

IUPAC1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one
SMILESCCC(=O)N1CCCC(C)(CC)C1
InChIInChI=1S/C11H21NO/c1-4-10(13)12-8-6-7-11(3,5-2)9-12/h4-9H2,1-3H3
InChIKeyYFVPJDJHHDRMBU-UHFFFAOYSA-N
MW183.29 g/mol
LogP2.44
Rot. Bonds2

About 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one

1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one (PubChem CID 127370172) has the molecular formula C11H21NO and a molecular weight of 183.29 g/mol. Its IUPAC name is 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one.

Molecular Properties

Compound Name1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one
PubChem CID127370172
Molecular FormulaC11H21NO
Molecular Weight183.29 g/mol
Exact Mass183.16
IUPAC Name1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one
SMILESCCC(=O)N1CCCC(C)(CC)C1
InChIInChI=1S/C11H21NO/c1-4-10(13)12-8-6-7-11(3,5-2)9-12/h4-9H2,1-3H3
InChIKeyYFVPJDJHHDRMBU-UHFFFAOYSA-N
XLogP2.44
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.29
LogP ≤ 52.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-(3-ethyl-3-methylpiperidin-1-yl)propan-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

3-amino-1-(3-ethyl-3-methylpiperidin-1-yl)butan-1-one;hydrochloride
CID 119789084
(2S)-2-amino-1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one
CID 130762944
1-(3,3-difluoropiperidin-1-yl)propan-1-one
CID 89382158
azetidin-1-yl-[(3S)-3-ethyl-3-methylpyrrolidin-1-yl]methanone
CID 118447951
1-(3-ethyl-3-methylpiperidin-1-yl)-2-(2-methoxyethylamino)ethanone;hydrochloride
CID 119789092
4-[3-(3-ethyl-3-methylpiperidin-1-yl)-3-oxopropyl]benzoic acid
CID 120692021
3-amino-1-(3-ethyl-3-methylpiperidin-1-yl)-3-phenylpropan-1-one
CID 119951631
(2S)-2-amino-1-(3-ethyl-3-methylpiperidin-1-yl)-4-methylpentan-1-one
CID 119789099
(2S)-2-amino-1-(3-ethyl-3-methylpiperidin-1-yl)-4-methylpentan-1-one;hydrochloride
CID 119789098
2-amino-1-(3-ethyl-3-methylpiperidin-1-yl)-3-methoxypropan-1-one;hydrochloride
CID 120991246
1-(3-methyl-3-sulfanylpyrrolidin-1-yl)propan-1-one
CID 123989065
(2-aminophenyl)-(3-ethyl-3-methylpiperidin-1-yl)methanone
CID 119945515

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one?
The IUPAC name of 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one (CID 127370172) is 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one.
What is the SMILES notation for 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one?
The canonical SMILES for 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one is CCC(=O)N1CCCC(C)(CC)C1.
What is the InChIKey of 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one?
The InChIKey is YFVPJDJHHDRMBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO/c1-4-10(13)12-8-6-7-11(3,5-2)9-12/h4-9H2,1-3H3.
What are the key properties of 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one?
1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one has a molecular weight of 183.29 g/mol, XLogP of 2.44, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-3-methylpiperidin-1-yl)propan-1-one is sourced from PubChem (CID 127370172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).