[1-(3,3-dimethylbutyl)cyclobutyl]methanol

C11H22O — CID 66023658

IUPAC[1-(3,3-dimethylbutyl)cyclobutyl]methanol
SMILESCC(C)(C)CCC1(CO)CCC1
InChIInChI=1S/C11H22O/c1-10(2,3)7-8-11(9-12)5-4-6-11/h12H,4-9H2,1-3H3
InChIKeyXWMNABXRIBPQAY-UHFFFAOYSA-N
MW170.30 g/mol
LogP2.98
Rot. Bonds3

About [1-(3,3-dimethylbutyl)cyclobutyl]methanol

[1-(3,3-dimethylbutyl)cyclobutyl]methanol (PubChem CID 66023658) has the molecular formula C11H22O and a molecular weight of 170.30 g/mol. Its IUPAC name is [1-(3,3-dimethylbutyl)cyclobutyl]methanol.

Molecular Properties

Compound Name[1-(3,3-dimethylbutyl)cyclobutyl]methanol
PubChem CID66023658
Molecular FormulaC11H22O
Molecular Weight170.30 g/mol
Exact Mass170.17
IUPAC Name[1-(3,3-dimethylbutyl)cyclobutyl]methanol
SMILESCC(C)(C)CCC1(CO)CCC1
InChIInChI=1S/C11H22O/c1-10(2,3)7-8-11(9-12)5-4-6-11/h12H,4-9H2,1-3H3
InChIKeyXWMNABXRIBPQAY-UHFFFAOYSA-N
XLogP2.98
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(chloromethyl)-1-(3,3-dimethylbutyl)cyclobutane
CID 66035776
[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]cyclobutyl]methanol
CID 112592330
[1-(3,3-dimethylbutyl)cyclooctyl]methanamine
CID 80603562
(1-butylcyclobutyl)methanol
CID 12786214
[1-[1-(hydroxymethyl)cycloundecyl]cycloundecyl]methanol
CID 22328250
(1-ethylcycloheptyl)methanol
CID 56982411
1-(3,3-dimethylbutyl)cycloheptan-1-ol
CID 65147849
[1-(3-chloropropyl)cyclobutyl]methanol
CID 55298559
[1-[(tert-butylamino)methyl]cyclopentyl]methanol
CID 154955274
(1-propylcyclopropyl)methanol
CID 66026334
[1-(methylsulfanylmethyl)cyclobutyl]methanol
CID 139383517
1-(3,3-dimethylbutyl)cyclopropane-1-carbaldehyde
CID 131231052

Frequently Asked Questions

What is the IUPAC name of [1-(3,3-dimethylbutyl)cyclobutyl]methanol?
The IUPAC name of [1-(3,3-dimethylbutyl)cyclobutyl]methanol (CID 66023658) is [1-(3,3-dimethylbutyl)cyclobutyl]methanol.
What is the SMILES notation for [1-(3,3-dimethylbutyl)cyclobutyl]methanol?
The canonical SMILES for [1-(3,3-dimethylbutyl)cyclobutyl]methanol is CC(C)(C)CCC1(CO)CCC1.
What is the InChIKey of [1-(3,3-dimethylbutyl)cyclobutyl]methanol?
The InChIKey is XWMNABXRIBPQAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O/c1-10(2,3)7-8-11(9-12)5-4-6-11/h12H,4-9H2,1-3H3.
What are the key properties of [1-(3,3-dimethylbutyl)cyclobutyl]methanol?
[1-(3,3-dimethylbutyl)cyclobutyl]methanol has a molecular weight of 170.30 g/mol, XLogP of 2.98, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,3-dimethylbutyl)cyclobutyl]methanol is sourced from PubChem (CID 66023658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).