(E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene

C32H64 — CID 54602757

IUPAC(E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene
SMILESCCCC/C=C(\C)CCCCCCCCC.CCCCCCCC/C=C(\C)CCCCC
InChIInChI=1S/2C16H32/c2*1-4-6-8-9-10-11-13-15-16(3)14-12-7-5-2/h15H,4-14H2,1-3H3;14H,4-13,15H2,1-3H3/b16-15+;16-14+
InChIKeyKDRCWPTUPORZDU-GGCIBKKJSA-N
MW448.86 g/mol
LogP12.53
Rot. Bonds22

About (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene

(E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene (PubChem CID 54602757) has the molecular formula C32H64 and a molecular weight of 448.86 g/mol. Its IUPAC name is (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene.

Molecular Properties

Compound Name(E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene
PubChem CID54602757
Molecular FormulaC32H64
Molecular Weight448.86 g/mol
Exact Mass448.50
IUPAC Name(E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene
SMILESCCCC/C=C(\C)CCCCCCCCC.CCCCCCCC/C=C(\C)CCCCC
InChIInChI=1S/2C16H32/c2*1-4-6-8-9-10-11-13-15-16(3)14-12-7-5-2/h15H,4-14H2,1-3H3;14H,4-13,15H2,1-3H3/b16-15+;16-14+
InChIKeyKDRCWPTUPORZDU-GGCIBKKJSA-N
XLogP12.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds22
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500448.86
LogP ≤ 512.53
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 (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-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

6-methyldocos-6-ene
CID 629460
(E)-9-methylnonadec-9-ene
CID 14783585
7-methylhenicos-7-ene
CID 173033031
(E)-10-methylnonadec-9-ene
CID 5364653
7-methyloctadec-7-ene
CID 123477460
4-methylhexadec-4-ene
CID 174447790
(E)-1-bromo-5-methylicos-4-ene
CID 172556960
(E)-3-methyldec-3-en-1-ol
CID 6428571
3-methyldec-3-en-1-ol
CID 78409313
2,6-dimethyltetradeca-2,6-diene
CID 57189781
3-methylicos-3-ene
CID 91445266
4-methylheptadec-3-ene
CID 59169426

Frequently Asked Questions

What is the IUPAC name of (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene?
The IUPAC name of (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene (CID 54602757) is (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene.
What is the SMILES notation for (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene?
The canonical SMILES for (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene is CCCC/C=C(\C)CCCCCCCCC.CCCCCCCC/C=C(\C)CCCCC.
What is the InChIKey of (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene?
The InChIKey is KDRCWPTUPORZDU-GGCIBKKJSA-N. The full InChI is InChI=1S/2C16H32/c2*1-4-6-8-9-10-11-13-15-16(3)14-12-7-5-2/h15H,4-14H2,1-3H3;14H,4-13,15H2,1-3H3/b16-15+;16-14+.
What are the key properties of (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene?
(E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene has a molecular weight of 448.86 g/mol, XLogP of 12.53, 22 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-methylpentadec-5-ene;(E)-6-methylpentadec-6-ene is sourced from PubChem (CID 54602757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).