3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol

C16H32N2O — CID 64736070

IUPAC3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCC1CC(C)C(CN(C)C2CCN(C)CC2)C(O)C1
InChIInChI=1S/C16H32N2O/c1-12-9-13(2)15(16(19)10-12)11-18(4)14-5-7-17(3)8-6-14/h12-16,19H,5-11H2,1-4H3
InChIKeyOYTKHROCJDCWAL-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.06
Rot. Bonds3

About 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol

3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol (PubChem CID 64736070) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
PubChem CID64736070
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC Name3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol
SMILESCC1CC(C)C(CN(C)C2CCN(C)CC2)C(O)C1
InChIInChI=1S/C16H32N2O/c1-12-9-13(2)15(16(19)10-12)11-18(4)14-5-7-17(3)8-6-14/h12-16,19H,5-11H2,1-4H3
InChIKeyOYTKHROCJDCWAL-UHFFFAOYSA-N
XLogP2.06
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
The IUPAC name of 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol (CID 64736070) is 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol.
What is the SMILES notation for 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
The canonical SMILES for 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol is CC1CC(C)C(CN(C)C2CCN(C)CC2)C(O)C1.
What is the InChIKey of 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
The InChIKey is OYTKHROCJDCWAL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-12-9-13(2)15(16(19)10-12)11-18(4)14-5-7-17(3)8-6-14/h12-16,19H,5-11H2,1-4H3.
What are the key properties of 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol?
3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol has a molecular weight of 268.44 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-2-[[methyl-(1-methylpiperidin-4-yl)amino]methyl]cyclohexan-1-ol is sourced from PubChem (CID 64736070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).