3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole

C24H18ClN — CID 122628074

IUPAC3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole
SMILESClc1ccc(/C=C/c2c(/C=C/c3ccccc3)[nH]c3ccccc23)cc1
InChIInChI=1S/C24H18ClN/c25-20-14-10-19(11-15-20)12-16-22-21-8-4-5-9-23(21)26-24(22)17-13-18-6-2-1-3-7-18/h1-17,26H/b16-12+,17-13+
InChIKeyAEMVIIUIHDRIHT-UNZYHPAISA-N
MW355.87 g/mol
LogP7.16
Rot. Bonds4

About 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole

3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole (PubChem CID 122628074) has the molecular formula C24H18ClN and a molecular weight of 355.87 g/mol. Its IUPAC name is 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole.

Molecular Properties

Compound Name3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole
PubChem CID122628074
Molecular FormulaC24H18ClN
Molecular Weight355.87 g/mol
Exact Mass355.11
IUPAC Name3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole
SMILESClc1ccc(/C=C/c2c(/C=C/c3ccccc3)[nH]c3ccccc23)cc1
InChIInChI=1S/C24H18ClN/c25-20-14-10-19(11-15-20)12-16-22-21-8-4-5-9-23(21)26-24(22)17-13-18-6-2-1-3-7-18/h1-17,26H/b16-12+,17-13+
InChIKeyAEMVIIUIHDRIHT-UNZYHPAISA-N
XLogP7.16
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500355.87
LogP ≤ 57.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2-[(E)-2-phenylethenyl]-3-[(E)-2-pyridin-4-ylethenyl]-1H-indole
CID 122628095
2-[(E)-2-(4-fluorophenyl)ethenyl]-3-[(E)-2-(4-iodophenyl)ethenyl]-1H-indole
CID 122647787
3-benzoyl-4-[(E)-2-(4-chlorophenyl)ethenyl]-1H-quinolin-2-one
CID 155809362
3-chloro-2-(2-phenylethenyl)-1H-quinolin-4-one
CID 91989561
2,3-bis[(E)-2-(2-fluorophenyl)ethenyl]-1H-indole
CID 122628076
4-[(E)-2-[3-[(E)-2-(4-hydroxycyclohexa-1,3-dien-1-yl)ethenyl]-1H-indol-2-yl]ethenyl]phenol
CID 163781025
phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone
CID 10314121
3-acetyl-4-[(E)-2-phenylethenyl]-1H-quinolin-2-one
CID 162395799
2,3-bis[(E)-2-(3-fluoro-4-pyridinyl)ethenyl]-1H-indole
CID 122630227
2-[(E)-2-[2-[(E)-2-(1,3-thiazol-2-yl)ethenyl]-1H-indol-3-yl]ethenyl]-1,3-thiazole
CID 122628108
9H-carbazole;[(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
CID 87061574
6-bromo-2-[(E)-2-(4-chlorophenyl)ethenyl]-1H-indole-3-carboxylic acid
CID 118657858

Frequently Asked Questions

What is the IUPAC name of 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole?
The IUPAC name of 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole (CID 122628074) is 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole.
What is the SMILES notation for 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole?
The canonical SMILES for 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole is Clc1ccc(/C=C/c2c(/C=C/c3ccccc3)[nH]c3ccccc23)cc1.
What is the InChIKey of 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole?
The InChIKey is AEMVIIUIHDRIHT-UNZYHPAISA-N. The full InChI is InChI=1S/C24H18ClN/c25-20-14-10-19(11-15-20)12-16-22-21-8-4-5-9-23(21)26-24(22)17-13-18-6-2-1-3-7-18/h1-17,26H/b16-12+,17-13+.
What are the key properties of 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole?
3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole has a molecular weight of 355.87 g/mol, XLogP of 7.16, 4 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole is sourced from PubChem (CID 122628074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).