(E)-14-ethylnonadec-7-ene

C21H42 — CID 173194393

IUPAC(E)-14-ethylnonadec-7-ene
SMILESCCCCCC/C=C/CCCCCC(CC)CCCCC
InChIInChI=1S/C21H42/c1-4-7-9-10-11-12-13-14-15-16-18-20-21(6-3)19-17-8-5-2/h12-13,21H,4-11,14-20H2,1-3H3/b13-12+
InChIKeyQORNSNUUKOKEMV-OUKQBFOZSA-N
MW294.57 g/mol
LogP8.07
Rot. Bonds16

About (E)-14-ethylnonadec-7-ene

(E)-14-ethylnonadec-7-ene (PubChem CID 173194393) has the molecular formula C21H42 and a molecular weight of 294.57 g/mol. Its IUPAC name is (E)-14-ethylnonadec-7-ene.

Molecular Properties

Compound Name(E)-14-ethylnonadec-7-ene
PubChem CID173194393
Molecular FormulaC21H42
Molecular Weight294.57 g/mol
Exact Mass294.33
IUPAC Name(E)-14-ethylnonadec-7-ene
SMILESCCCCCC/C=C/CCCCCC(CC)CCCCC
InChIInChI=1S/C21H42/c1-4-7-9-10-11-12-13-14-15-16-18-20-21(6-3)19-17-8-5-2/h12-13,21H,4-11,14-20H2,1-3H3/b13-12+
InChIKeyQORNSNUUKOKEMV-OUKQBFOZSA-N
XLogP8.07
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.57
LogP ≤ 58.07
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)-14-ethylnonadec-7-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

16-ethylhenicos-6-ene
CID 173194293
(E)-19-ethylhexacos-12-ene
CID 173194168
16-ethyldocos-10-ene
CID 91389222
(E)-5,22-diethylhexacos-11-ene
CID 173194569
15,19-diethyltetracos-2-ene
CID 173194589
11-ethyltetradec-4-ene
CID 123216279
(9Z,12Z)-19-ethyltetracosa-9,12-dienal
CID 173398960
7-ethyltetracosane
CID 22223872
7-ethyltetradecane
CID 529902
3-octadec-9-enylpentane-1,5-diol
CID 91381537
12-ethylhentriacontane
CID 91805956
15-ethyltetratriacontane
CID 23358557

Frequently Asked Questions

What is the IUPAC name of (E)-14-ethylnonadec-7-ene?
The IUPAC name of (E)-14-ethylnonadec-7-ene (CID 173194393) is (E)-14-ethylnonadec-7-ene.
What is the SMILES notation for (E)-14-ethylnonadec-7-ene?
The canonical SMILES for (E)-14-ethylnonadec-7-ene is CCCCCC/C=C/CCCCCC(CC)CCCCC.
What is the InChIKey of (E)-14-ethylnonadec-7-ene?
The InChIKey is QORNSNUUKOKEMV-OUKQBFOZSA-N. The full InChI is InChI=1S/C21H42/c1-4-7-9-10-11-12-13-14-15-16-18-20-21(6-3)19-17-8-5-2/h12-13,21H,4-11,14-20H2,1-3H3/b13-12+.
What are the key properties of (E)-14-ethylnonadec-7-ene?
(E)-14-ethylnonadec-7-ene has a molecular weight of 294.57 g/mol, XLogP of 8.07, 16 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-14-ethylnonadec-7-ene is sourced from PubChem (CID 173194393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).