(1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol

C10H16O — CID 130905987

IUPAC(1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol
SMILESC=C(C)[C@@H]1C=C[C@@H](O)[C@H](C)C1
InChIInChI=1S/C10H16O/c1-7(2)9-4-5-10(11)8(3)6-9/h4-5,8-11H,1,6H2,2-3H3/t8-,9-,10-/m1/s1
InChIKeyUBTIZKNMXAJQJG-OPRDCNLKSA-N
MW152.24 g/mol
LogP2.14
Rot. Bonds1

About (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol

(1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol (PubChem CID 130905987) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol.

Molecular Properties

Compound Name(1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol
PubChem CID130905987
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name(1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol
SMILESC=C(C)[C@@H]1C=C[C@@H](O)[C@H](C)C1
InChIInChI=1S/C10H16O/c1-7(2)9-4-5-10(11)8(3)6-9/h4-5,8-11H,1,6H2,2-3H3/t8-,9-,10-/m1/s1
InChIKeyUBTIZKNMXAJQJG-OPRDCNLKSA-N
XLogP2.14
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.14
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 (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol?
The IUPAC name of (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol (CID 130905987) is (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol.
What is the SMILES notation for (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol?
The canonical SMILES for (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol is C=C(C)[C@@H]1C=C[C@@H](O)[C@H](C)C1.
What is the InChIKey of (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol?
The InChIKey is UBTIZKNMXAJQJG-OPRDCNLKSA-N. The full InChI is InChI=1S/C10H16O/c1-7(2)9-4-5-10(11)8(3)6-9/h4-5,8-11H,1,6H2,2-3H3/t8-,9-,10-/m1/s1.
What are the key properties of (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol?
(1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol has a molecular weight of 152.24 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,4S,6R)-6-methyl-4-prop-1-en-2-ylcyclohex-2-en-1-ol is sourced from PubChem (CID 130905987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).