3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol

C14H27NO — CID 64746461

IUPAC3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol
SMILESCC1CCNC(C2(O)CCC(C)C(C)C2)C1
InChIInChI=1S/C14H27NO/c1-10-5-7-15-13(8-10)14(16)6-4-11(2)12(3)9-14/h10-13,15-16H,4-9H2,1-3H3
InChIKeyNISAHPYRQXRBGR-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.56
Rot. Bonds1

About 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol

3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol (PubChem CID 64746461) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol
PubChem CID64746461
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol
SMILESCC1CCNC(C2(O)CCC(C)C(C)C2)C1
InChIInChI=1S/C14H27NO/c1-10-5-7-15-13(8-10)14(16)6-4-11(2)12(3)9-14/h10-13,15-16H,4-9H2,1-3H3
InChIKeyNISAHPYRQXRBGR-UHFFFAOYSA-N
XLogP2.56
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol?
The IUPAC name of 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol (CID 64746461) is 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol.
What is the SMILES notation for 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol?
The canonical SMILES for 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol is CC1CCNC(C2(O)CCC(C)C(C)C2)C1.
What is the InChIKey of 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol?
The InChIKey is NISAHPYRQXRBGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-10-5-7-15-13(8-10)14(16)6-4-11(2)12(3)9-14/h10-13,15-16H,4-9H2,1-3H3.
What are the key properties of 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol?
3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol has a molecular weight of 225.38 g/mol, XLogP of 2.56, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dimethyl-1-(4-methylpiperidin-2-yl)cyclohexan-1-ol is sourced from PubChem (CID 64746461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).