phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone

C23H17NO — CID 10314121

IUPACphenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone
SMILESO=C(c1ccccc1)c1c(/C=C/c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C23H17NO/c25-23(18-11-5-2-6-12-18)22-19-13-7-8-14-20(19)24-21(22)16-15-17-9-3-1-4-10-17/h1-16,24H/b16-15+
InChIKeyFKDBPBFONDRNIX-FOCLMDBBSA-N
MW323.40 g/mol
LogP5.57
Rot. Bonds4

About phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone

phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone (PubChem CID 10314121) has the molecular formula C23H17NO and a molecular weight of 323.40 g/mol. Its IUPAC name is phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone.

Molecular Properties

Compound Namephenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone
PubChem CID10314121
Molecular FormulaC23H17NO
Molecular Weight323.40 g/mol
Exact Mass323.13
IUPAC Namephenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone
SMILESO=C(c1ccccc1)c1c(/C=C/c2ccccc2)[nH]c2ccccc12
InChIInChI=1S/C23H17NO/c25-23(18-11-5-2-6-12-18)22-19-13-7-8-14-20(19)24-21(22)16-15-17-9-3-1-4-10-17/h1-16,24H/b16-15+
InChIKeyFKDBPBFONDRNIX-FOCLMDBBSA-N
XLogP5.57
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500323.40
LogP ≤ 55.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

9H-carbazole;phenyl-[2-(2-phenylethenyl)phenyl]methanone
CID 162206940
3-benzoyl-4-[(E)-2-(4-chlorophenyl)ethenyl]-1H-quinolin-2-one
CID 155809362
3-benzoyl-1H-indole-2-carboxylic acid
CID 22917099
(2-fluoro-1H-indol-3-yl)-phenylmethanone
CID 175455866
4-amino-3-benzoyl-1H-quinolin-2-one
CID 11737142
3-acetyl-4-[(E)-2-phenylethenyl]-1H-quinolin-2-one
CID 162395799
1-[2-[(Z)-prop-1-enyl]-1H-indol-3-yl]ethenol
CID 143138999
3-chloro-2-(2-phenylethenyl)-1H-quinolin-4-one
CID 91989561
3-[(E)-2-(4-chlorophenyl)ethenyl]-2-[(E)-2-phenylethenyl]-1H-indole
CID 122628074
2-[(E)-2-phenylethenyl]-3-[(E)-2-pyridin-4-ylethenyl]-1H-indole
CID 122628095
ethyl 2-[(E)-2-phenylethenyl]-1H-pyrrolo[3,2-c]pyridine-3-carboxylate
CID 46867743
9H-carbazole;[(1E,3E)-4-phenylbuta-1,3-dienyl]benzene
CID 87061574

Frequently Asked Questions

What is the IUPAC name of phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone?
The IUPAC name of phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone (CID 10314121) is phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone.
What is the SMILES notation for phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone?
The canonical SMILES for phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone is O=C(c1ccccc1)c1c(/C=C/c2ccccc2)[nH]c2ccccc12.
What is the InChIKey of phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone?
The InChIKey is FKDBPBFONDRNIX-FOCLMDBBSA-N. The full InChI is InChI=1S/C23H17NO/c25-23(18-11-5-2-6-12-18)22-19-13-7-8-14-20(19)24-21(22)16-15-17-9-3-1-4-10-17/h1-16,24H/b16-15+.
What are the key properties of phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone?
phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone has a molecular weight of 323.40 g/mol, XLogP of 5.57, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl-[2-[(E)-2-phenylethenyl]-1H-indol-3-yl]methanone is sourced from PubChem (CID 10314121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).