3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol

C15H26O2 — CID 75051828

IUPAC3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol
SMILESCC1=CC(O)CC(C)=CC(O)C(C(C)C)CC1
InChIInChI=1S/C15H26O2/c1-10(2)14-6-5-11(3)7-13(16)8-12(4)9-15(14)17/h7,9-10,13-17H,5-6,8H2,1-4H3
InChIKeyQNMWLBQJIVQIBA-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.06
Rot. Bonds1

About 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol

3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol (PubChem CID 75051828) has the molecular formula C15H26O2 and a molecular weight of 238.37 g/mol. Its IUPAC name is 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol.

Molecular Properties

Compound Name3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol
PubChem CID75051828
Molecular FormulaC15H26O2
Molecular Weight238.37 g/mol
Exact Mass238.19
IUPAC Name3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol
SMILESCC1=CC(O)CC(C)=CC(O)C(C(C)C)CC1
InChIInChI=1S/C15H26O2/c1-10(2)14-6-5-11(3)7-13(16)8-12(4)9-15(14)17/h7,9-10,13-17H,5-6,8H2,1-4H3
InChIKeyQNMWLBQJIVQIBA-UHFFFAOYSA-N
XLogP3.06
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol 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

(2E,6E,10E)-3,7,11-trimethyl-14-propan-2-ylcyclotetradeca-2,6,10-trien-1-ol
CID 13255921
(1R,3R,4E,7R,8Z,12S,13E)-1,5,9-trimethyl-12-propan-2-ylcyclotetradeca-4,8,13-triene-1,3,7-triol
CID 162922332
(3aR,6E,8S,10E)-8-hydroxy-6,10-dimethyl-3-methylidene-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-2-one
CID 118701730
1-(2,4-dimethylcyclohex-3-en-1-yl)ethanol
CID 118112369
(2S,4S,5E,8S,9S)-4,8-dihydroxy-2,6-dimethyl-9-propan-2-ylcyclodec-5-en-1-one
CID 102066677
2-[(1R,6R)-3-methyl-6-propan-2-ylcyclohex-2-en-1-yl]acetaldehyde
CID 146512482
(1R,2E,6S,7E,9R,12E)-9-methoxy-3,9,13-trimethyl-6-propan-2-ylcyclotetradeca-2,7,12-trien-1-ol
CID 15812567
(1S,6R)-6-(2-hydroxypropan-2-yl)-3-methylcyclohex-2-en-1-ol
CID 6431167
4,4,7-trimethyl-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalene
CID 72512205
(1S,6R,14R)-4,8,12,15,15-pentamethylbicyclo[12.1.0]pentadeca-4,8,12-trien-6-ol
CID 162866573
(1S,2R,4aR,8aR)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalen-2-ol
CID 163193673
(1S,2S,4aR,8aR)-7-methyl-4-methylidene-1-propan-2-yl-2,3,4a,5,6,8a-hexahydro-1H-naphthalen-2-ol
CID 162908885

Frequently Asked Questions

What is the IUPAC name of 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol?
The IUPAC name of 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol (CID 75051828) is 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol.
What is the SMILES notation for 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol?
The canonical SMILES for 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol is CC1=CC(O)CC(C)=CC(O)C(C(C)C)CC1.
What is the InChIKey of 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol?
The InChIKey is QNMWLBQJIVQIBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26O2/c1-10(2)14-6-5-11(3)7-13(16)8-12(4)9-15(14)17/h7,9-10,13-17H,5-6,8H2,1-4H3.
What are the key properties of 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol?
3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol has a molecular weight of 238.37 g/mol, XLogP of 3.06, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,7-dimethyl-10-propan-2-ylcyclodeca-2,6-diene-1,5-diol is sourced from PubChem (CID 75051828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).