(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone

C13H24N2O2 — CID 81115944

IUPAC(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone
SMILESCC1NCCCC1C(=O)N1CCC(C)(O)CC1
InChIInChI=1S/C13H24N2O2/c1-10-11(4-3-7-14-10)12(16)15-8-5-13(2,17)6-9-15/h10-11,14,17H,3-9H2,1-2H3
InChIKeyIVODCERKGNACGH-UHFFFAOYSA-N
MW240.35 g/mol
LogP0.75
Rot. Bonds1

About (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone

(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone (PubChem CID 81115944) has the molecular formula C13H24N2O2 and a molecular weight of 240.35 g/mol. Its IUPAC name is (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone.

Molecular Properties

Compound Name(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone
PubChem CID81115944
Molecular FormulaC13H24N2O2
Molecular Weight240.35 g/mol
Exact Mass240.18
IUPAC Name(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone
SMILESCC1NCCCC1C(=O)N1CCC(C)(O)CC1
InChIInChI=1S/C13H24N2O2/c1-10-11(4-3-7-14-10)12(16)15-8-5-13(2,17)6-9-15/h10-11,14,17H,3-9H2,1-2H3
InChIKeyIVODCERKGNACGH-UHFFFAOYSA-N
XLogP0.75
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.35
LogP ≤ 50.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone 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

(4-hydroxy-4-methylazepan-1-yl)-(2-methylpiperidin-3-yl)methanone
CID 107404728
(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 81103357
[(2R,3S)-2-methylpiperidin-3-yl]-piperidin-1-ylmethanone
CID 97050947
(4-hydroxy-4-methylpiperidin-1-yl)-(4-methylpiperidin-2-yl)methanone
CID 114424311
4-ethyl-1-(2-methylpyrrolidine-3-carbonyl)piperidine-4-carboxylic acid
CID 79384911
(2-aminocycloheptyl)-(4-hydroxy-4-methylazepan-1-yl)methanone
CID 107404307
2-(4,4-dimethylpiperidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 103978731
(2-methylpyrrolidin-3-yl)-(1-oxo-1,4-thiazinan-4-yl)methanone
CID 79388557
(2-methylpyrrolidin-3-yl)-(4-propan-2-ylpiperidin-1-yl)methanone
CID 102953558
(3-hydroxy-3-methylpyrrolidin-1-yl)-[(2S)-piperidin-2-yl]methanone
CID 103356057
(3,5-dimethylpiperidin-1-yl)-(2-methylpyrrolidin-3-yl)methanone
CID 79383471
(2-methylpyrrolidin-3-yl)-(3-methylpyrrolidin-1-yl)methanone
CID 79388150

Frequently Asked Questions

What is the IUPAC name of (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone?
The IUPAC name of (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone (CID 81115944) is (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone.
What is the SMILES notation for (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone?
The canonical SMILES for (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone is CC1NCCCC1C(=O)N1CCC(C)(O)CC1.
What is the InChIKey of (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone?
The InChIKey is IVODCERKGNACGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O2/c1-10-11(4-3-7-14-10)12(16)15-8-5-13(2,17)6-9-15/h10-11,14,17H,3-9H2,1-2H3.
What are the key properties of (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone?
(4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone has a molecular weight of 240.35 g/mol, XLogP of 0.75, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxy-4-methylpiperidin-1-yl)-(2-methylpiperidin-3-yl)methanone is sourced from PubChem (CID 81115944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).