1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol

C15H28O2 — CID 24972329

IUPAC1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol
SMILESC=C(C)C(CCCC)OCC1(O)CCCCC1
InChIInChI=1S/C15H28O2/c1-4-5-9-14(13(2)3)17-12-15(16)10-7-6-8-11-15/h14,16H,2,4-12H2,1,3H3
InChIKeySIWWIVVPPSHJJE-UHFFFAOYSA-N
MW240.39 g/mol
LogP3.83
Rot. Bonds7

About 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol

1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol (PubChem CID 24972329) has the molecular formula C15H28O2 and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol
PubChem CID24972329
Molecular FormulaC15H28O2
Molecular Weight240.39 g/mol
Exact Mass240.21
IUPAC Name1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol
SMILESC=C(C)C(CCCC)OCC1(O)CCCCC1
InChIInChI=1S/C15H28O2/c1-4-5-9-14(13(2)3)17-12-15(16)10-7-6-8-11-15/h14,16H,2,4-12H2,1,3H3
InChIKeySIWWIVVPPSHJJE-UHFFFAOYSA-N
XLogP3.83
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-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

1-(2-ethylhexyl)cycloheptan-1-ol
CID 63406622
1-(2-ethylhexyl)cyclohexan-1-ol
CID 63409044
3-(methoxymethoxy)-2-methylnon-1-ene
CID 542508
[(2-Methylhept-1-en-3-yl)oxy]di(propan-2-yl)silane
CID 78061225
1-octadecylcyclohexan-1-ol
CID 67204292
1-heptylcycloheptan-1-ol
CID 57057960
1-[(hexan-2-ylamino)methyl]cyclopentan-1-ol
CID 65105584
1-(1-hydroxydodecyl)cyclohexan-1-ol
CID 23056048
1-(1-hydroxytridecyl)cyclohexan-1-ol
CID 103451628
2-[(1-hydroxycyclohexyl)methylamino]hexanoic acid
CID 103253670
1-(methoxymethyl)cyclohexan-1-ol
CID 12552140
2-methyltridec-1-en-3-yl hydrogen carbonate
CID 156777797

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol?
The IUPAC name of 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol (CID 24972329) is 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol.
What is the SMILES notation for 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol?
The canonical SMILES for 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol is C=C(C)C(CCCC)OCC1(O)CCCCC1.
What is the InChIKey of 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol?
The InChIKey is SIWWIVVPPSHJJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28O2/c1-4-5-9-14(13(2)3)17-12-15(16)10-7-6-8-11-15/h14,16H,2,4-12H2,1,3H3.
What are the key properties of 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol?
1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 3.83, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylhept-1-en-3-yloxymethyl)cyclohexan-1-ol is sourced from PubChem (CID 24972329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).