cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol

C7H14O — CID 153486186

IUPACcis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol
SMILESCC(C)[C@H]1CC[C@H]1O
InChIInChI=1S/C7H14O/c1-5(2)6-3-4-7(6)8/h5-8H,3-4H2,1-2H3/t6-,7-/m1/s1
InChIKeyDRKAZICIBNCLBJ-RNFRBKRXSA-N
MW114.19 g/mol
LogP1.41
Rot. Bonds1

About cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol

cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol (PubChem CID 153486186) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol.

Molecular Properties

Compound Namecis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol
PubChem CID153486186
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Namecis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol
SMILESCC(C)[C@H]1CC[C@H]1O
InChIInChI=1S/C7H14O/c1-5(2)6-3-4-7(6)8/h5-8H,3-4H2,1-2H3/t6-,7-/m1/s1
InChIKeyDRKAZICIBNCLBJ-RNFRBKRXSA-N
XLogP1.41
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(1R,3R,4S)-4-propan-2-ylcyclohexane-1,3-diol
CID 130918219
(1S,2S,4R)-4-methyl-2-propan-2-ylcyclohexan-1-ol
CID 15605903
CID 66630118
CID 66630118
hypochlorous acid;5-methyl-2-propan-2-ylcyclohexan-1-ol
CID 174568794
trans-(1R,5R)-5-amino-2-propan-2-ylcyclohexan-1-ol
CID 130207945
(1S)-1,2-di(propan-2-yl)cyclopentane
CID 161356354
(1R,2S,3R)-3-[(1S)-1-hydroxyethyl]cyclopentane-1,2-diol
CID 57379190
(1R,2R,4S,5R)-5-propan-2-ylcyclohexane-1,2,4-triol
CID 157009791
(3S,4R)-1-methyl-4-propan-2-ylpiperidin-3-ol
CID 121424108
(1R)-5,5-dimethyl-2-propan-2-ylcyclohexan-1-ol
CID 134302475
trans-(1S,2R)-5,5-difluoro-2-propan-2-ylcyclohexan-1-ol;trans-(1S,2R)-2-propan-2-ylcyclohexan-1-ol
CID 159846173
trans-(3R,6S)-3-methyl-6-propan-2-ylcyclohexane-1,2-diol
CID 130927478

Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol?
The IUPAC name of cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol (CID 153486186) is cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol.
What is the SMILES notation for cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol?
The canonical SMILES for cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol is CC(C)[C@H]1CC[C@H]1O.
What is the InChIKey of cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol?
The InChIKey is DRKAZICIBNCLBJ-RNFRBKRXSA-N. The full InChI is InChI=1S/C7H14O/c1-5(2)6-3-4-7(6)8/h5-8H,3-4H2,1-2H3/t6-,7-/m1/s1.
What are the key properties of cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol?
cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol has a molecular weight of 114.19 g/mol, XLogP of 1.41, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-2-propan-2-ylcyclobutan-1-ol is sourced from PubChem (CID 153486186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).