trans-1(7),8-p-Menthadien-2-ol

C10H16O — CID 6428442

IUPACcis-(1S,5R)-2-methylidene-5-prop-1-en-2-ylcyclohexan-1-ol
SMILESCC(=C)[C@@H]1CCC(=C)[C@H](C1)O
InChIInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h9-11H,1,3-6H2,2H3/t9-,10+/m1/s1
InChIKeyPNVTXOFNJFHXOK-ZJUUUORDSA-N
MW152.23 g/mol
LogP2.30
Rot. Bonds1

About trans-1(7),8-p-Menthadien-2-ol

trans-1(7),8-p-Menthadien-2-ol (PubChem CID 6428442) has the molecular formula C10H16O and a molecular weight of 152.23 g/mol. Its IUPAC name is cis-(1S,5R)-2-methylidene-5-prop-1-en-2-ylcyclohexan-1-ol.

Molecular Properties

Compound Nametrans-1(7),8-p-Menthadien-2-ol
PubChem CID6428442
Molecular FormulaC10H16O
Molecular Weight152.23 g/mol
Exact Mass152.12
IUPAC Namecis-(1S,5R)-2-methylidene-5-prop-1-en-2-ylcyclohexan-1-ol
SMILESCC(=C)[C@@H]1CCC(=C)[C@H](C1)O
InChIInChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h9-11H,1,3-6H2,2H3/t9-,10+/m1/s1
InChIKeyPNVTXOFNJFHXOK-ZJUUUORDSA-N
XLogP2.30
TPSA20.20 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity181

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.23
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze trans-1(7),8-p-Menthadien-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(-)-Isopulegol
CID 170833
Cyclohexanol, 5-methyl-2-(1-methylethenyl)-
CID 24585
2-Methyl-5-(1-methylethenyl)cyclohexanol
CID 12072
Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, (1R,2R,5R)-rel-
CID 443163
Dihydrocarveol, (+-)-
CID 89755
(1S,2S,4R)-iso-dihydrocarveol
CID 443165
2-Methylidene-5-(prop-1-en-2-yl)cyclohexan-1-ol
CID 527427
(1S,2R,5R)-2-Methyl-5-(1-methylethenyl)cyclohexanol
CID 443164
Neoisopulegol
CID 6553885
Cyclohexanol, 2-methyl-5-(1-methylethenyl)-, (1R,2S,5R)-rel-
CID 443166
cis-p-Mentha-1(7),8-dien-2-ol
CID 6429040
Cyclohexanepropanol, alpha,2,2-trimethyl-6-methylene-
CID 114559

Frequently Asked Questions

What is the IUPAC name of trans-1(7),8-p-Menthadien-2-ol?
The IUPAC name of trans-1(7),8-p-Menthadien-2-ol (CID 6428442) is cis-(1S,5R)-2-methylidene-5-prop-1-en-2-ylcyclohexan-1-ol.
What is the SMILES notation for trans-1(7),8-p-Menthadien-2-ol?
The canonical SMILES for trans-1(7),8-p-Menthadien-2-ol is CC(=C)[C@@H]1CCC(=C)[C@H](C1)O.
What is the InChIKey of trans-1(7),8-p-Menthadien-2-ol?
The InChIKey is PNVTXOFNJFHXOK-ZJUUUORDSA-N. The full InChI is InChI=1S/C10H16O/c1-7(2)9-5-4-8(3)10(11)6-9/h9-11H,1,3-6H2,2H3/t9-,10+/m1/s1.
What are the key properties of trans-1(7),8-p-Menthadien-2-ol?
trans-1(7),8-p-Menthadien-2-ol has a molecular weight of 152.23 g/mol, XLogP of 2.30, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trans-1(7),8-p-Menthadien-2-ol is sourced from PubChem (CID 6428442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).