[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol

C14H27NO — CID 104550202

IUPAC[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol
SMILESCC1CCN(CC2CCCCC2CO)CC1
InChIInChI=1S/C14H27NO/c1-12-6-8-15(9-7-12)10-13-4-2-3-5-14(13)11-16/h12-14,16H,2-11H2,1H3
InChIKeyGTUGBAXAPUZBJT-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.52
Rot. Bonds3

About [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol

[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol (PubChem CID 104550202) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol
PubChem CID104550202
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol
SMILESCC1CCN(CC2CCCCC2CO)CC1
InChIInChI=1S/C14H27NO/c1-12-6-8-15(9-7-12)10-13-4-2-3-5-14(13)11-16/h12-14,16H,2-11H2,1H3
InChIKeyGTUGBAXAPUZBJT-UHFFFAOYSA-N
XLogP2.52
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol?
The IUPAC name of [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol (CID 104550202) is [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol.
What is the SMILES notation for [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol?
The canonical SMILES for [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol is CC1CCN(CC2CCCCC2CO)CC1.
What is the InChIKey of [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol?
The InChIKey is GTUGBAXAPUZBJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-12-6-8-15(9-7-12)10-13-4-2-3-5-14(13)11-16/h12-14,16H,2-11H2,1H3.
What are the key properties of [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol?
[2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol has a molecular weight of 225.38 g/mol, XLogP of 2.52, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(4-methylpiperidin-1-yl)methyl]cyclohexyl]methanol is sourced from PubChem (CID 104550202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).