methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol

C10H18O — CID 70010822

IUPACmethane;5-prop-1-en-2-ylcyclohex-2-en-1-ol
SMILESC.C=C(C)C1CC=CC(O)C1
InChIInChI=1S/C9H14O.CH4/c1-7(2)8-4-3-5-9(10)6-8;/h3,5,8-10H,1,4,6H2,2H3;1H4
InChIKeyAIZRPQUMGVSOMA-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.53
Rot. Bonds1

About methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol

methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol (PubChem CID 70010822) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol.

Molecular Properties

Compound Namemethane;5-prop-1-en-2-ylcyclohex-2-en-1-ol
PubChem CID70010822
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Namemethane;5-prop-1-en-2-ylcyclohex-2-en-1-ol
SMILESC.C=C(C)C1CC=CC(O)C1
InChIInChI=1S/C9H14O.CH4/c1-7(2)8-4-3-5-9(10)6-8;/h3,5,8-10H,1,4,6H2,2H3;1H4
InChIKeyAIZRPQUMGVSOMA-UHFFFAOYSA-N
XLogP2.53
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.53
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 methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol?
The IUPAC name of methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol (CID 70010822) is methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol.
What is the SMILES notation for methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol?
The canonical SMILES for methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol is C.C=C(C)C1CC=CC(O)C1.
What is the InChIKey of methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol?
The InChIKey is AIZRPQUMGVSOMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O.CH4/c1-7(2)8-4-3-5-9(10)6-8;/h3,5,8-10H,1,4,6H2,2H3;1H4.
What are the key properties of methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol?
methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;5-prop-1-en-2-ylcyclohex-2-en-1-ol is sourced from PubChem (CID 70010822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).