(4R)-1-cyclobutyl-3,3,4-trimethylpiperidine

C12H23N — CID 171846999

IUPAC(4R)-1-cyclobutyl-3,3,4-trimethylpiperidine
SMILESC[C@@H]1CCN(C2CCC2)CC1(C)C
InChIInChI=1S/C12H23N/c1-10-7-8-13(9-12(10,2)3)11-5-4-6-11/h10-11H,4-9H2,1-3H3/t10-/m1/s1
InChIKeyDBZQMWKJJASQGT-SNVBAGLBSA-N
MW181.32 g/mol
LogP2.91
Rot. Bonds1

About (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine

(4R)-1-cyclobutyl-3,3,4-trimethylpiperidine (PubChem CID 171846999) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine.

Molecular Properties

Compound Name(4R)-1-cyclobutyl-3,3,4-trimethylpiperidine
PubChem CID171846999
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name(4R)-1-cyclobutyl-3,3,4-trimethylpiperidine
SMILESC[C@@H]1CCN(C2CCC2)CC1(C)C
InChIInChI=1S/C12H23N/c1-10-7-8-13(9-12(10,2)3)11-5-4-6-11/h10-11H,4-9H2,1-3H3/t10-/m1/s1
InChIKeyDBZQMWKJJASQGT-SNVBAGLBSA-N
XLogP2.91
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine 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

(4R)-1-cyclobutyl-3,3,4-trimethylpiperidine;hydrate
CID 171846998
[3-(3,3,4-trimethylpiperidin-1-yl)cyclobutyl] hypoiodite
CID 166077704
1-(1-cycloheptyl-3,3-dimethylpiperidin-4-yl)-N-methylmethanamine
CID 117025004
1-cyclobutyl-4,4-dimethylpiperidine
CID 70344031
1-(1-ethylazepan-4-yl)-3,3-dimethylpiperidin-4-amine
CID 114267616
3,3-dimethyl-1-(3,3,4-trimethylcyclohexyl)piperidine;ethane
CID 143483566
(4R)-3,3-difluoro-4-methyl-1-(oxan-4-yl)piperidine
CID 144948013
3,3-dimethyl-1-[(1R,4S)-3,3,4-trimethylcyclohexyl]piperidine;propane
CID 160999736
1-cyclohexyl-4-(4-methylpiperidin-1-yl)piperidine
CID 1121684
1-cycloheptyl-3,3-dimethyl-1,4-diazepane
CID 64944315
1-cyclobutyl-N,4-dimethylpiperidin-4-amine
CID 115304164
1-cyclobutyl-3-fluoro-4-methylpiperidine
CID 130674980

Frequently Asked Questions

What is the IUPAC name of (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine?
The IUPAC name of (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine (CID 171846999) is (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine.
What is the SMILES notation for (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine?
The canonical SMILES for (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine is C[C@@H]1CCN(C2CCC2)CC1(C)C.
What is the InChIKey of (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine?
The InChIKey is DBZQMWKJJASQGT-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H23N/c1-10-7-8-13(9-12(10,2)3)11-5-4-6-11/h10-11H,4-9H2,1-3H3/t10-/m1/s1.
What are the key properties of (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine?
(4R)-1-cyclobutyl-3,3,4-trimethylpiperidine has a molecular weight of 181.32 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-cyclobutyl-3,3,4-trimethylpiperidine is sourced from PubChem (CID 171846999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).