10-methylundecane-2,6-diol

C12H26O2 — CID 88681561

IUPAC10-methylundecane-2,6-diol
SMILESCC(C)CCCC(O)CCCC(C)O
InChIInChI=1S/C12H26O2/c1-10(2)6-4-8-12(14)9-5-7-11(3)13/h10-14H,4-9H2,1-3H3
InChIKeyISZHEFXEKWSPKP-UHFFFAOYSA-N
MW202.34 g/mol
LogP2.72
Rot. Bonds8

About 10-methylundecane-2,6-diol

10-methylundecane-2,6-diol (PubChem CID 88681561) has the molecular formula C12H26O2 and a molecular weight of 202.34 g/mol. Its IUPAC name is 10-methylundecane-2,6-diol.

Molecular Properties

Compound Name10-methylundecane-2,6-diol
PubChem CID88681561
Molecular FormulaC12H26O2
Molecular Weight202.34 g/mol
Exact Mass202.19
IUPAC Name10-methylundecane-2,6-diol
SMILESCC(C)CCCC(O)CCCC(C)O
InChIInChI=1S/C12H26O2/c1-10(2)6-4-8-12(14)9-5-7-11(3)13/h10-14H,4-9H2,1-3H3
InChIKeyISZHEFXEKWSPKP-UHFFFAOYSA-N
XLogP2.72
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.34
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 10-methylundecane-2,6-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

(2S,6S)-6,10-dimethylundecan-2-ol
CID 92938997
17-methyloctadecane-1,11-diol
CID 91311361
octadecane-2,14-diol
CID 170722506
(3S,25S)-hexacosane-1,3,25-triol
CID 163073285
1-(dimethylamino)octane-2,7-diol
CID 123214691
pentadecane-2,5,8,11,14-pentol
CID 175190041
6-methyl-1-propan-2-yloxyheptan-2-ol
CID 105122821
(4R)-8-methylnon-1-en-4-ol
CID 11672703
(3R)-10-methylundecan-3-ol
CID 164999222
(2S)-24-methylpentacosane-1,2-diol
CID 162845743
ethane;5-methylhexan-2-ol
CID 144624886
7-methyl-1-methylsulfonyloctan-4-ol
CID 63192258

Frequently Asked Questions

What is the IUPAC name of 10-methylundecane-2,6-diol?
The IUPAC name of 10-methylundecane-2,6-diol (CID 88681561) is 10-methylundecane-2,6-diol.
What is the SMILES notation for 10-methylundecane-2,6-diol?
The canonical SMILES for 10-methylundecane-2,6-diol is CC(C)CCCC(O)CCCC(C)O.
What is the InChIKey of 10-methylundecane-2,6-diol?
The InChIKey is ISZHEFXEKWSPKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2/c1-10(2)6-4-8-12(14)9-5-7-11(3)13/h10-14H,4-9H2,1-3H3.
What are the key properties of 10-methylundecane-2,6-diol?
10-methylundecane-2,6-diol has a molecular weight of 202.34 g/mol, XLogP of 2.72, 8 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 10-methylundecane-2,6-diol is sourced from PubChem (CID 88681561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).