5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol

C15H24O — CID 71444825

IUPAC5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol
SMILESC=C1C=CC(C(C)CCC=C(C)C)CC1O
InChIInChI=1S/C15H24O/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,8-9,12,14-16H,4-5,7,10H2,1-3H3
InChIKeyUNSGLJWOHGSVLW-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.86
Rot. Bonds4

About 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol

5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol (PubChem CID 71444825) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol.

Molecular Properties

Compound Name5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol
PubChem CID71444825
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol
SMILESC=C1C=CC(C(C)CCC=C(C)C)CC1O
InChIInChI=1S/C15H24O/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,8-9,12,14-16H,4-5,7,10H2,1-3H3
InChIKeyUNSGLJWOHGSVLW-UHFFFAOYSA-N
XLogP3.86
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol?
The IUPAC name of 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol (CID 71444825) is 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol.
What is the SMILES notation for 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol?
The canonical SMILES for 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol is C=C1C=CC(C(C)CCC=C(C)C)CC1O.
What is the InChIKey of 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol?
The InChIKey is UNSGLJWOHGSVLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-11(2)6-5-7-12(3)14-9-8-13(4)15(16)10-14/h6,8-9,12,14-16H,4-5,7,10H2,1-3H3.
What are the key properties of 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol?
5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol has a molecular weight of 220.36 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(6-methylhept-5-en-2-yl)-2-methylidenecyclohex-3-en-1-ol is sourced from PubChem (CID 71444825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).