2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol

C11H22O2 — CID 130150641

IUPAC2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(C)(CO)C(O)C1
InChIInChI=1S/C11H22O2/c1-8(2)9-4-5-11(3,7-12)10(13)6-9/h8-10,12-13H,4-7H2,1-3H3
InChIKeyOKXWCJLFCGIILS-UHFFFAOYSA-N
MW186.29 g/mol
LogP1.80
Rot. Bonds2

About 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol

2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol (PubChem CID 130150641) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Name2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol
PubChem CID130150641
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol
SMILESCC(C)C1CCC(C)(CO)C(O)C1
InChIInChI=1S/C11H22O2/c1-8(2)9-4-5-11(3,7-12)10(13)6-9/h8-10,12-13H,4-7H2,1-3H3
InChIKeyOKXWCJLFCGIILS-UHFFFAOYSA-N
XLogP1.80
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

trans-(2R,4R)-1-methyl-4-propan-2-ylcyclohexane-1,2-diol
CID 54292427
2,2-dimethyl-8-propan-2-yl-1-oxaspiro[4.5]decan-6-ol
CID 12527840
[(1R,4aR,4bS,7R,8aR,10aR)-1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,8,8a,9,10,10a-dodecahydrophenanthren-1-yl]methanol
CID 76966698
[(1R,3R)-3-propan-2-ylcyclopentyl]methanol
CID 59340916
1-[(1R,2S,4S)-2-methoxy-1-methyl-4-propan-2-ylcyclohexyl]propan-2-one
CID 102493096
1-methyl-4-propan-2-ylcyclohexan-1-ol;hydrate
CID 141162449
4-propan-2-ylcyclopentane-1,2-diol
CID 20608687
cis-(2S,5S)-2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-one
CID 130926086
CID 174102089
CID 174102089
1-methyl-4-propan-2-ylbicyclo[4.1.0]heptane
CID 15579949
[(1S,2R,4S)-1,2,4-trimethylcyclohexyl]methanol
CID 7061819
1-bromo-1-methyl-4-propan-2-ylcyclohexane
CID 90475813

Frequently Asked Questions

What is the IUPAC name of 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol?
The IUPAC name of 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol (CID 130150641) is 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol.
What is the SMILES notation for 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol?
The canonical SMILES for 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol is CC(C)C1CCC(C)(CO)C(O)C1.
What is the InChIKey of 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol?
The InChIKey is OKXWCJLFCGIILS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-8(2)9-4-5-11(3,7-12)10(13)6-9/h8-10,12-13H,4-7H2,1-3H3.
What are the key properties of 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol?
2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol has a molecular weight of 186.29 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(hydroxymethyl)-2-methyl-5-propan-2-ylcyclohexan-1-ol is sourced from PubChem (CID 130150641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).