[(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol

C10H18O — CID 12558031

IUPAC[(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol
SMILESCC(C)[C@]12CC[C@@H](CO)[C@H]1C2
InChIInChI=1S/C10H18O/c1-7(2)10-4-3-8(6-11)9(10)5-10/h7-9,11H,3-6H2,1-2H3/t8-,9+,10+/m0/s1
InChIKeyCUEPRUIGEZADHM-IVZWLZJFSA-N
MW154.25 g/mol
LogP2.05
Rot. Bonds2

About [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol

[(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol (PubChem CID 12558031) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol.

Molecular Properties

Compound Name[(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol
PubChem CID12558031
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name[(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol
SMILESCC(C)[C@]12CC[C@@H](CO)[C@H]1C2
InChIInChI=1S/C10H18O/c1-7(2)10-4-3-8(6-11)9(10)5-10/h7-9,11H,3-6H2,1-2H3/t8-,9+,10+/m0/s1
InChIKeyCUEPRUIGEZADHM-IVZWLZJFSA-N
XLogP2.05
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol?
The IUPAC name of [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol (CID 12558031) is [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol.
What is the SMILES notation for [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol?
The canonical SMILES for [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol is CC(C)[C@]12CC[C@@H](CO)[C@H]1C2.
What is the InChIKey of [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol?
The InChIKey is CUEPRUIGEZADHM-IVZWLZJFSA-N. The full InChI is InChI=1S/C10H18O/c1-7(2)10-4-3-8(6-11)9(10)5-10/h7-9,11H,3-6H2,1-2H3/t8-,9+,10+/m0/s1.
What are the key properties of [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol?
[(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol has a molecular weight of 154.25 g/mol, XLogP of 2.05, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R,2R,5R)-5-propan-2-yl-2-bicyclo[3.1.0]hexanyl]methanol is sourced from PubChem (CID 12558031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).