[4-(cyclobutylmethoxy)cyclohexyl]methanol

C12H22O2 — CID 106825263

IUPAC[4-(cyclobutylmethoxy)cyclohexyl]methanol
SMILESOCC1CCC(OCC2CCC2)CC1
InChIInChI=1S/C12H22O2/c13-8-10-4-6-12(7-5-10)14-9-11-2-1-3-11/h10-13H,1-9H2
InChIKeyOXFCFYIUSRJRBU-UHFFFAOYSA-N
MW198.31 g/mol
LogP2.35
Rot. Bonds4

About [4-(cyclobutylmethoxy)cyclohexyl]methanol

[4-(cyclobutylmethoxy)cyclohexyl]methanol (PubChem CID 106825263) has the molecular formula C12H22O2 and a molecular weight of 198.31 g/mol. Its IUPAC name is [4-(cyclobutylmethoxy)cyclohexyl]methanol.

Molecular Properties

Compound Name[4-(cyclobutylmethoxy)cyclohexyl]methanol
PubChem CID106825263
Molecular FormulaC12H22O2
Molecular Weight198.31 g/mol
Exact Mass198.16
IUPAC Name[4-(cyclobutylmethoxy)cyclohexyl]methanol
SMILESOCC1CCC(OCC2CCC2)CC1
InChIInChI=1S/C12H22O2/c13-8-10-4-6-12(7-5-10)14-9-11-2-1-3-11/h10-13H,1-9H2
InChIKeyOXFCFYIUSRJRBU-UHFFFAOYSA-N
XLogP2.35
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1,4-bis(cyclopropylmethoxy)cyclohexane
CID 147967519
1-(cyclohexylmethoxy)-4-methylcyclohexane
CID 21137244
[4-(2-methylpropoxy)cyclohexyl]methanol
CID 106825238
3-(cyclopropylmethoxy)cyclohexan-1-ol
CID 79618368
cyclobutylmethanol;ethanol
CID 68532840
1-(cycloheptyloxymethyl)-4-dodecoxycycloheptane
CID 91616970
[4-(methoxymethyl)cyclohexyl]methanol
CID 19938783
cyclotetradecylmethanol
CID 23468347
[4-(3-methylbut-2-enoxy)cyclohexyl]methanol
CID 106825560
3-(cyclobutylmethoxy)azetidine;hydrochloride
CID 75365400
tert-butyl 4-[[4-(hydroxymethyl)cyclohexyl]methoxy]piperidine-1-carboxylate
CID 176864103
10-[[4-(10-tricyclo[5.2.1.02,6]decanyloxymethyl)cyclohexyl]methoxy]tricyclo[5.2.1.02,6]decane
CID 71095798

Frequently Asked Questions

What is the IUPAC name of [4-(cyclobutylmethoxy)cyclohexyl]methanol?
The IUPAC name of [4-(cyclobutylmethoxy)cyclohexyl]methanol (CID 106825263) is [4-(cyclobutylmethoxy)cyclohexyl]methanol.
What is the SMILES notation for [4-(cyclobutylmethoxy)cyclohexyl]methanol?
The canonical SMILES for [4-(cyclobutylmethoxy)cyclohexyl]methanol is OCC1CCC(OCC2CCC2)CC1.
What is the InChIKey of [4-(cyclobutylmethoxy)cyclohexyl]methanol?
The InChIKey is OXFCFYIUSRJRBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22O2/c13-8-10-4-6-12(7-5-10)14-9-11-2-1-3-11/h10-13H,1-9H2.
What are the key properties of [4-(cyclobutylmethoxy)cyclohexyl]methanol?
[4-(cyclobutylmethoxy)cyclohexyl]methanol has a molecular weight of 198.31 g/mol, XLogP of 2.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(cyclobutylmethoxy)cyclohexyl]methanol is sourced from PubChem (CID 106825263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).