1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene

C25H32 — CID 141224926

IUPAC1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene
SMILESCCCC1CCC(c2ccc(C=Cc3ccc(CC)cc3)cc2)CC1
InChIInChI=1S/C25H32/c1-3-5-21-12-16-24(17-13-21)25-18-14-23(15-19-25)11-10-22-8-6-20(4-2)7-9-22/h6-11,14-15,18-19,21,24H,3-5,12-13,16-17H2,1-2H3
InChIKeyANZMGRHJBJFEKF-UHFFFAOYSA-N
MW332.53 g/mol
LogP7.49
Rot. Bonds6

About 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene

1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene (PubChem CID 141224926) has the molecular formula C25H32 and a molecular weight of 332.53 g/mol. Its IUPAC name is 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene.

Molecular Properties

Compound Name1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene
PubChem CID141224926
Molecular FormulaC25H32
Molecular Weight332.53 g/mol
Exact Mass332.25
IUPAC Name1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene
SMILESCCCC1CCC(c2ccc(C=Cc3ccc(CC)cc3)cc2)CC1
InChIInChI=1S/C25H32/c1-3-5-21-12-16-24(17-13-21)25-18-14-23(15-19-25)11-10-22-8-6-20(4-2)7-9-22/h6-11,14-15,18-19,21,24H,3-5,12-13,16-17H2,1-2H3
InChIKeyANZMGRHJBJFEKF-UHFFFAOYSA-N
XLogP7.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500332.53
LogP ≤ 57.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1-[(E)-prop-1-enyl]-4-[2-[4-(4-propylcyclohexyl)phenyl]ethyl]benzene
CID 22991361
1-chloro-4-[(E)-2-[4-[4-[2-(4-propylcyclohexyl)ethyl]cyclohexyl]phenyl]ethenyl]benzene
CID 67590386
pentafluoro-[4-[(E)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]phenyl]-λ6-sulfane
CID 25197320
1-[(E)-prop-1-enyl]-4-[4-(4-propylcyclohexyl)cyclohexyl]benzene
CID 59247481
carbamic acid;1-ethyl-4-(4-propylcyclohexyl)benzene
CID 70401958
4-(4-propylcyclohexyl)benzaldehyde
CID 14573359
3-[4-(4-propylcyclohexyl)phenyl]prop-2-enoic acid
CID 4201535
5-(4-ethylcyclohexyl)-2-[(Z)-2-[4-(4-propylcyclohexyl)phenyl]ethenyl]pyridine
CID 92971949
1-ethenyl-4-(4-propylcyclohexyl)cyclohexane;1-ethyl-4-[4-(4-propylcyclohexyl)phenyl]benzene
CID 145309431
1-[4-[(4-butylcyclohexyl)methyl]cyclohexyl]-4-ethylbenzene
CID 139724448
1-(4-ethylcyclohexyl)-4-(4-propylcyclohexyl)benzene
CID 20538372
1-(4-ethenylcyclohexyl)-4-[(E)-2-(4-propylcyclohexyl)ethenyl]benzene
CID 173068049

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene?
The IUPAC name of 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene (CID 141224926) is 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene.
What is the SMILES notation for 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene?
The canonical SMILES for 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene is CCCC1CCC(c2ccc(C=Cc3ccc(CC)cc3)cc2)CC1.
What is the InChIKey of 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene?
The InChIKey is ANZMGRHJBJFEKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H32/c1-3-5-21-12-16-24(17-13-21)25-18-14-23(15-19-25)11-10-22-8-6-20(4-2)7-9-22/h6-11,14-15,18-19,21,24H,3-5,12-13,16-17H2,1-2H3.
What are the key properties of 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene?
1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene has a molecular weight of 332.53 g/mol, XLogP of 7.49, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-[2-[4-(4-propylcyclohexyl)phenyl]ethenyl]benzene is sourced from PubChem (CID 141224926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).