(Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene

C14H24 — CID 143221988

IUPAC(Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene
SMILESC/C=C\C.CCC1=CC=C(CC)CC1
InChIInChI=1S/C10H16.C4H8/c1-3-9-5-7-10(4-2)8-6-9;1-3-4-2/h5,7H,3-4,6,8H2,1-2H3;3-4H,1-2H3/b;4-3-
InChIKeyOFLJUCVDDQQNMW-QGAMPUOQSA-N
MW192.35 g/mol
LogP5.04
Rot. Bonds2

About (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene

(Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene (PubChem CID 143221988) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene.

Molecular Properties

Compound Name(Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene
PubChem CID143221988
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name(Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene
SMILESC/C=C\C.CCC1=CC=C(CC)CC1
InChIInChI=1S/C10H16.C4H8/c1-3-9-5-7-10(4-2)8-6-9;1-3-4-2/h5,7H,3-4,6,8H2,1-2H3;3-4H,1-2H3/b;4-3-
InChIKeyOFLJUCVDDQQNMW-QGAMPUOQSA-N
XLogP5.04
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500192.35
LogP ≤ 55.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene 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-(4-ethylcyclohexa-1,3-dien-1-yl)acetonitrile
CID 129089439
1-ethyl-4-(trifluoromethyl)cyclohexa-1,3-diene
CID 89161594
1-ethyl-4-ethynylcyclohexa-1,3-diene
CID 163565857
1-ethyl-4-prop-1-en-2-ylcyclohexa-1,3-diene
CID 143168816
(4-ethylcyclohexa-1,3-dien-1-yl)-(4-methylcyclohexa-1,3-dien-1-yl)diazene
CID 91539939
1-bromo-4-(4-ethylcyclohexa-1,3-dien-1-yl)benzene
CID 71068147
1-[(E)-2-(4-ethylcyclohexa-1,3-dien-1-yl)ethenyl]-4-[(E)-2-phenylethenyl]benzene
CID 164529280
1-but-3-yn-2-yl-4-ethylcyclohexa-1,3-diene
CID 170621382
5-(4-ethylcyclohexa-1,3-dien-1-yl)hexan-2-ol
CID 142281390
5-(4-ethylcyclohexa-1,3-dien-1-yl)-2-methyl-1H-imidazole
CID 123237122
1-ethyl-4-propylcyclopenta-1,3-diene
CID 139667468
(5Z)-1-ethyl-5-ethylidenecyclohexa-1,3-diene
CID 163488938

Frequently Asked Questions

What is the IUPAC name of (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene?
The IUPAC name of (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene (CID 143221988) is (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene.
What is the SMILES notation for (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene?
The canonical SMILES for (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene is C/C=C\C.CCC1=CC=C(CC)CC1.
What is the InChIKey of (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene?
The InChIKey is OFLJUCVDDQQNMW-QGAMPUOQSA-N. The full InChI is InChI=1S/C10H16.C4H8/c1-3-9-5-7-10(4-2)8-6-9;1-3-4-2/h5,7H,3-4,6,8H2,1-2H3;3-4H,1-2H3/b;4-3-.
What are the key properties of (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene?
(Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene has a molecular weight of 192.35 g/mol, XLogP of 5.04, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-but-2-ene;1,4-diethylcyclohexa-1,3-diene is sourced from PubChem (CID 143221988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).