2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol

C15H29NO2 — CID 107395253

IUPAC2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol
SMILESCOC1(C)CCCN(CC2CC(C)CCC2O)C1
InChIInChI=1S/C15H29NO2/c1-12-5-6-14(17)13(9-12)10-16-8-4-7-15(2,11-16)18-3/h12-14,17H,4-11H2,1-3H3
InChIKeyQSZBYNTUHUMRCH-UHFFFAOYSA-N
MW255.40 g/mol
LogP2.28
Rot. Bonds3

About 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol

2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol (PubChem CID 107395253) has the molecular formula C15H29NO2 and a molecular weight of 255.40 g/mol. Its IUPAC name is 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol.

Molecular Properties

Compound Name2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol
PubChem CID107395253
Molecular FormulaC15H29NO2
Molecular Weight255.40 g/mol
Exact Mass255.22
IUPAC Name2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol
SMILESCOC1(C)CCCN(CC2CC(C)CCC2O)C1
InChIInChI=1S/C15H29NO2/c1-12-5-6-14(17)13(9-12)10-16-8-4-7-15(2,11-16)18-3/h12-14,17H,4-11H2,1-3H3
InChIKeyQSZBYNTUHUMRCH-UHFFFAOYSA-N
XLogP2.28
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.40
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-2,2-dimethylcyclohexan-1-amine
CID 107395119
4-methyl-2-[(2,2,6-trimethylmorpholin-4-yl)methyl]cyclohexan-1-ol
CID 62610121
N,4-diethyl-2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]cyclohexan-1-amine
CID 107395213
N-ethyl-3-[(3-methoxy-3-methylpiperidin-1-yl)methyl]oxan-4-amine
CID 107395161
4-methyl-2-[(3-propoxypiperidin-1-yl)methyl]cyclohexan-1-ol
CID 55094581
4-methyl-2-[(4-piperidin-1-ylpiperidin-1-yl)methyl]cyclohexan-1-ol
CID 62609383
2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]azepane
CID 107393237
N-(cyclopropylmethyl)-2-(3-methoxy-3-methylpiperidin-1-yl)ethanamine
CID 107393244
4-methyl-2-[(2-methylpyrrolidin-1-yl)methyl]cyclohexan-1-ol
CID 62610048
2-[(4,4-dimethylazepan-1-yl)methyl]-4-methylcyclohexan-1-amine
CID 65281870
2-(3-methoxy-3-methylpiperidin-1-yl)ethanethiol
CID 107396245
2-cyclopropyl-3-(3-methoxy-3-methylpiperidin-1-yl)-2-(methylamino)propan-1-ol
CID 107395999

Frequently Asked Questions

What is the IUPAC name of 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol?
The IUPAC name of 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol (CID 107395253) is 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol.
What is the SMILES notation for 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol?
The canonical SMILES for 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol is COC1(C)CCCN(CC2CC(C)CCC2O)C1.
What is the InChIKey of 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol?
The InChIKey is QSZBYNTUHUMRCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2/c1-12-5-6-14(17)13(9-12)10-16-8-4-7-15(2,11-16)18-3/h12-14,17H,4-11H2,1-3H3.
What are the key properties of 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol?
2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol has a molecular weight of 255.40 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxy-3-methylpiperidin-1-yl)methyl]-4-methylcyclohexan-1-ol is sourced from PubChem (CID 107395253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).