(4-methylcyclohexyl)-piperidin-4-ylmethanol

C13H25NO — CID 80560052

IUPAC(4-methylcyclohexyl)-piperidin-4-ylmethanol
SMILESCC1CCC(C(O)C2CCNCC2)CC1
InChIInChI=1S/C13H25NO/c1-10-2-4-11(5-3-10)13(15)12-6-8-14-9-7-12/h10-15H,2-9H2,1H3
InChIKeyIFLGFBQIZXPMOC-UHFFFAOYSA-N
MW211.35 g/mol
LogP2.17
Rot. Bonds2

About (4-methylcyclohexyl)-piperidin-4-ylmethanol

(4-methylcyclohexyl)-piperidin-4-ylmethanol (PubChem CID 80560052) has the molecular formula C13H25NO and a molecular weight of 211.35 g/mol. Its IUPAC name is (4-methylcyclohexyl)-piperidin-4-ylmethanol.

Molecular Properties

Compound Name(4-methylcyclohexyl)-piperidin-4-ylmethanol
PubChem CID80560052
Molecular FormulaC13H25NO
Molecular Weight211.35 g/mol
Exact Mass211.19
IUPAC Name(4-methylcyclohexyl)-piperidin-4-ylmethanol
SMILESCC1CCC(C(O)C2CCNCC2)CC1
InChIInChI=1S/C13H25NO/c1-10-2-4-11(5-3-10)13(15)12-6-8-14-9-7-12/h10-15H,2-9H2,1H3
InChIKeyIFLGFBQIZXPMOC-UHFFFAOYSA-N
XLogP2.17
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 52.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-methylcyclohexyl)-piperidin-4-ylmethanol?
The IUPAC name of (4-methylcyclohexyl)-piperidin-4-ylmethanol (CID 80560052) is (4-methylcyclohexyl)-piperidin-4-ylmethanol.
What is the SMILES notation for (4-methylcyclohexyl)-piperidin-4-ylmethanol?
The canonical SMILES for (4-methylcyclohexyl)-piperidin-4-ylmethanol is CC1CCC(C(O)C2CCNCC2)CC1.
What is the InChIKey of (4-methylcyclohexyl)-piperidin-4-ylmethanol?
The InChIKey is IFLGFBQIZXPMOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO/c1-10-2-4-11(5-3-10)13(15)12-6-8-14-9-7-12/h10-15H,2-9H2,1H3.
What are the key properties of (4-methylcyclohexyl)-piperidin-4-ylmethanol?
(4-methylcyclohexyl)-piperidin-4-ylmethanol has a molecular weight of 211.35 g/mol, XLogP of 2.17, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylcyclohexyl)-piperidin-4-ylmethanol is sourced from PubChem (CID 80560052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).