2,11-dimethyltridec-6-ene

C15H30 — CID 123657363

IUPAC2,11-dimethyltridec-6-ene
SMILESCCC(C)CCCC=CCCCC(C)C
InChIInChI=1S/C15H30/c1-5-15(4)13-11-9-7-6-8-10-12-14(2)3/h6-7,14-15H,5,8-13H2,1-4H3
InChIKeyMVYBGNRRVUKTCD-UHFFFAOYSA-N
MW210.41 g/mol
LogP5.59
Rot. Bonds9

About 2,11-dimethyltridec-6-ene

2,11-dimethyltridec-6-ene (PubChem CID 123657363) has the molecular formula C15H30 and a molecular weight of 210.41 g/mol. Its IUPAC name is 2,11-dimethyltridec-6-ene.

Molecular Properties

Compound Name2,11-dimethyltridec-6-ene
PubChem CID123657363
Molecular FormulaC15H30
Molecular Weight210.41 g/mol
Exact Mass210.23
IUPAC Name2,11-dimethyltridec-6-ene
SMILESCCC(C)CCCC=CCCCC(C)C
InChIInChI=1S/C15H30/c1-5-15(4)13-11-9-7-6-8-10-12-14(2)3/h6-7,14-15H,5,8-13H2,1-4H3
InChIKeyMVYBGNRRVUKTCD-UHFFFAOYSA-N
XLogP5.59
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500210.41
LogP ≤ 55.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 2,11-dimethyltridec-6-ene 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

8-methyldec-3-ene
CID 54115614
8-methylnon-3-ene
CID 54424784
2,9-dimethylundec-5-ene
CID 123952487
2,6,10,14,18,22,26-heptamethyloctacosane
CID 6428605
(E)-2,12-dimethyltridec-6-ene
CID 176630963
(Z)-2,11-dimethyldodec-6-ene;(E)-2,11-dimethyldodec-6-ene;(Z)-2,14-dimethylpentadec-6-ene;(E)-2,14-dimethylpentadec-6-ene
CID 161032897
2,6,10,15,19-pentamethylhenicosane
CID 6428617
(Z)-2,16-dimethylheptadec-6-ene
CID 176630987
magnesium;2,6-dimethyloctane;dibromide
CID 175146229
(E)-2,16-dimethylheptadec-6-ene
CID 176630989
2,11,23-trimethylpentacosane
CID 123728262
(E)-2,13-dimethyltetradec-7-ene
CID 176630990

Frequently Asked Questions

What is the IUPAC name of 2,11-dimethyltridec-6-ene?
The IUPAC name of 2,11-dimethyltridec-6-ene (CID 123657363) is 2,11-dimethyltridec-6-ene.
What is the SMILES notation for 2,11-dimethyltridec-6-ene?
The canonical SMILES for 2,11-dimethyltridec-6-ene is CCC(C)CCCC=CCCCC(C)C.
What is the InChIKey of 2,11-dimethyltridec-6-ene?
The InChIKey is MVYBGNRRVUKTCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-5-15(4)13-11-9-7-6-8-10-12-14(2)3/h6-7,14-15H,5,8-13H2,1-4H3.
What are the key properties of 2,11-dimethyltridec-6-ene?
2,11-dimethyltridec-6-ene has a molecular weight of 210.41 g/mol, XLogP of 5.59, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,11-dimethyltridec-6-ene is sourced from PubChem (CID 123657363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).