(2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol

C15H26O — CID 91666343

IUPAC(2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol
SMILESCC(C)=CCCC(C)[C@]12CC[C@@](C)(O)C1C2
InChIInChI=1S/C15H26O/c1-11(2)6-5-7-12(3)15-9-8-14(4,16)13(15)10-15/h6,12-13,16H,5,7-10H2,1-4H3/t12?,13?,14-,15-/m1/s1
InChIKeyIRDFGGRWKUKANK-NEXFUWMNSA-N
MW222.37 g/mol
LogP3.92
Rot. Bonds4

About (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol

(2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol (PubChem CID 91666343) has the molecular formula C15H26O and a molecular weight of 222.37 g/mol. Its IUPAC name is (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol.

Molecular Properties

Compound Name(2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol
PubChem CID91666343
Molecular FormulaC15H26O
Molecular Weight222.37 g/mol
Exact Mass222.20
IUPAC Name(2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol
SMILESCC(C)=CCCC(C)[C@]12CC[C@@](C)(O)C1C2
InChIInChI=1S/C15H26O/c1-11(2)6-5-7-12(3)15-9-8-14(4,16)13(15)10-15/h6,12-13,16H,5,7-10H2,1-4H3/t12?,13?,14-,15-/m1/s1
InChIKeyIRDFGGRWKUKANK-NEXFUWMNSA-N
XLogP3.92
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.37
LogP ≤ 53.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol with MolForge

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Related Compounds

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2-(1,8-Dimethylspiro[4.5]dec-8-en-4-yl)propan-2-ol
CID 14105905
Agarospirol
CID 21675005
(2R,5S)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo(3.1.0)hexan-2-ol
CID 6428435
Alpha-acorenol
CID 11972555
beta-Acorenol
CID 14105907

Frequently Asked Questions

What is the IUPAC name of (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol?
The IUPAC name of (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol (CID 91666343) is (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol.
What is the SMILES notation for (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol?
The canonical SMILES for (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol is CC(C)=CCCC(C)[C@]12CC[C@@](C)(O)C1C2.
What is the InChIKey of (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol?
The InChIKey is IRDFGGRWKUKANK-NEXFUWMNSA-N. The full InChI is InChI=1S/C15H26O/c1-11(2)6-5-7-12(3)15-9-8-14(4,16)13(15)10-15/h6,12-13,16H,5,7-10H2,1-4H3/t12?,13?,14-,15-/m1/s1.
What are the key properties of (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol?
(2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol has a molecular weight of 222.37 g/mol, XLogP of 3.92, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,5R)-2-methyl-5-(6-methylhept-5-en-2-yl)bicyclo[3.1.0]hexan-2-ol is sourced from PubChem (CID 91666343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).