7-ethyl-2-methylundecan-6-ol

C14H30O — CID 115829942

IUPAC7-ethyl-2-methylundecan-6-ol
SMILESCCCCC(CC)C(O)CCCC(C)C
InChIInChI=1S/C14H30O/c1-5-7-10-13(6-2)14(15)11-8-9-12(3)4/h12-15H,5-11H2,1-4H3
InChIKeyVEZONCKWDPTZJV-UHFFFAOYSA-N
MW214.39 g/mol
LogP4.39
Rot. Bonds9

About 7-ethyl-2-methylundecan-6-ol

7-ethyl-2-methylundecan-6-ol (PubChem CID 115829942) has the molecular formula C14H30O and a molecular weight of 214.39 g/mol. Its IUPAC name is 7-ethyl-2-methylundecan-6-ol.

Molecular Properties

Compound Name7-ethyl-2-methylundecan-6-ol
PubChem CID115829942
Molecular FormulaC14H30O
Molecular Weight214.39 g/mol
Exact Mass214.23
IUPAC Name7-ethyl-2-methylundecan-6-ol
SMILESCCCCC(CC)C(O)CCCC(C)C
InChIInChI=1S/C14H30O/c1-5-7-10-13(6-2)14(15)11-8-9-12(3)4/h12-15H,5-11H2,1-4H3
InChIKeyVEZONCKWDPTZJV-UHFFFAOYSA-N
XLogP4.39
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.39
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 7-ethyl-2-methylundecan-6-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

2-Ethylhexanol
CID 7720
3,7-Dimethyl-1-octanol
CID 7792
2-Ethyl-1,3-Hexanediol
CID 7211
Tetrahydrolinalool
CID 6548
2,6-Dimethyl-4-heptanol
CID 7957
2-Butyl-1-octanol
CID 19800
3,7-Dimethyl-1,7-octanediol
CID 249494
2-Methyloctanol
CID 102495
4-tert-Butylcyclohexanol
CID 7391
1-Cyclohexylethanol
CID 137829
2,6,8-Trimethyl-4-nonanol
CID 61056
4-Methyl-3-heptanol
CID 26989

Frequently Asked Questions

What is the IUPAC name of 7-ethyl-2-methylundecan-6-ol?
The IUPAC name of 7-ethyl-2-methylundecan-6-ol (CID 115829942) is 7-ethyl-2-methylundecan-6-ol.
What is the SMILES notation for 7-ethyl-2-methylundecan-6-ol?
The canonical SMILES for 7-ethyl-2-methylundecan-6-ol is CCCCC(CC)C(O)CCCC(C)C.
What is the InChIKey of 7-ethyl-2-methylundecan-6-ol?
The InChIKey is VEZONCKWDPTZJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O/c1-5-7-10-13(6-2)14(15)11-8-9-12(3)4/h12-15H,5-11H2,1-4H3.
What are the key properties of 7-ethyl-2-methylundecan-6-ol?
7-ethyl-2-methylundecan-6-ol has a molecular weight of 214.39 g/mol, XLogP of 4.39, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-2-methylundecan-6-ol is sourced from PubChem (CID 115829942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).