2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol

C16H31NO — CID 62931964

IUPAC2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(N2CCC(C)(C)CC2)C1
InChIInChI=1S/C16H31NO/c1-12(2)13-5-6-15(18)14(11-13)17-9-7-16(3,4)8-10-17/h12-15,18H,5-11H2,1-4H3
InChIKeyCBPMQTOFRKQMFM-UHFFFAOYSA-N
MW253.43 g/mol
LogP3.29
Rot. Bonds2

About 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol

2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol (PubChem CID 62931964) has the molecular formula C16H31NO and a molecular weight of 253.43 g/mol. Its IUPAC name is 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol
PubChem CID62931964
Molecular FormulaC16H31NO
Molecular Weight253.43 g/mol
Exact Mass253.24
IUPAC Name2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(O)C(N2CCC(C)(C)CC2)C1
InChIInChI=1S/C16H31NO/c1-12(2)13-5-6-15(18)14(11-13)17-9-7-16(3,4)8-10-17/h12-15,18H,5-11H2,1-4H3
InChIKeyCBPMQTOFRKQMFM-UHFFFAOYSA-N
XLogP3.29
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.43
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol 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-(4,4-dimethylazepan-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 65281648
2-(4-cyclopentylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 62708468
2-(4-tert-butylpiperazin-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 62704133
2-(3-methylpyrrolidin-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 62707731
2-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)-4-propan-2-ylcyclohexan-1-ol
CID 79174564
2-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-4-propan-2-ylcyclohexan-1-ol
CID 79934726
2-(4,4-dimethylpiperidin-1-yl)cyclooctan-1-ol
CID 62930764
2-(4,4-dimethylazepan-1-yl)-4,4-dimethylcyclohexan-1-ol
CID 65282366
3-(4,4-dimethylpiperidin-1-yl)-4-methylcyclohexan-1-ol
CID 165491669
2-(5,6-dimethylbenzimidazol-1-yl)-4-propan-2-ylcyclohexan-1-ol
CID 62709033
cis-(1S,5R)-2-methyl-5-propan-2-ylcyclohexan-1-ol
CID 168820123
1-(1-hydroxy-4,4-dimethylcyclohexyl)-4-propan-2-ylcyclohexane-1-carbonitrile
CID 79133079

Frequently Asked Questions

What is the IUPAC name of 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol (CID 62931964) is 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol is CC(C)C1CCC(O)C(N2CCC(C)(C)CC2)C1.
What is the InChIKey of 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
The InChIKey is CBPMQTOFRKQMFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO/c1-12(2)13-5-6-15(18)14(11-13)17-9-7-16(3,4)8-10-17/h12-15,18H,5-11H2,1-4H3.
What are the key properties of 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol?
2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol has a molecular weight of 253.43 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4,4-dimethylpiperidin-1-yl)-4-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 62931964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).