(3Z)-3-(2-phenylethylidene)indole

C16H13N — CID 135017063

IUPAC(3Z)-3-(2-phenylethylidene)indole
SMILESC1=Nc2ccccc2/C1=C/Cc1ccccc1
InChIInChI=1S/C16H13N/c1-2-6-13(7-3-1)10-11-14-12-17-16-9-5-4-8-15(14)16/h1-9,11-12H,10H2/b14-11+
InChIKeyLQPFZAJKOIPEAN-SDNWHVSQSA-N
MW219.29 g/mol
LogP4.03
Rot. Bonds2

About (3Z)-3-(2-phenylethylidene)indole

(3Z)-3-(2-phenylethylidene)indole (PubChem CID 135017063) has the molecular formula C16H13N and a molecular weight of 219.29 g/mol. Its IUPAC name is (3Z)-3-(2-phenylethylidene)indole.

Molecular Properties

Compound Name(3Z)-3-(2-phenylethylidene)indole
PubChem CID135017063
Molecular FormulaC16H13N
Molecular Weight219.29 g/mol
Exact Mass219.10
IUPAC Name(3Z)-3-(2-phenylethylidene)indole
SMILESC1=Nc2ccccc2/C1=C/Cc1ccccc1
InChIInChI=1S/C16H13N/c1-2-6-13(7-3-1)10-11-14-12-17-16-9-5-4-8-15(14)16/h1-9,11-12H,10H2/b14-11+
InChIKeyLQPFZAJKOIPEAN-SDNWHVSQSA-N
XLogP4.03
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.29
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze (3Z)-3-(2-phenylethylidene)indole 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

(2Z)-2-indol-3-ylideneacetate
CID 154586201
4-[(E)-indol-3-ylidenemethyl]-5-(phenoxymethyl)-1,2-dihydropyrazol-3-one
CID 22059829
5-[(Z)-indol-3-ylidenemethyl]-2-phenyl-1H-imidazol-4-ol
CID 135986108
6-phenylhexa-2,4-dienylbenzene;titanium
CID 161467723
(2Z)-2-[(2Z)-2-indol-3-ylideneethylidene]-1-methylquinoline;hydroiodide
CID 171377083
4-(indol-3-ylidenemethyl)-5-methyl-2-phenyl-1H-pyrazol-3-one
CID 723084
5-(indol-3-ylidenemethyl)-2,3-dimethylimidazol-4-ol
CID 136691181
(2E)-2-(2-pyridin-3-ylethylidene)-1H-quinoxaline
CID 175349484
4-(indol-3-ylidenemethyl)-3-methyl-2H-1,2-oxazol-5-one
CID 27868285
3-(diethylaminomethyl)-4-hydroxy-5-(indol-3-ylidenemethyl)-1,3-thiazol-2-one
CID 135912325
3-[(2-fluorophenyl)methyl]-4-hydroxy-5-[(Z)-indol-3-ylidenemethyl]-1H-imidazol-2-one
CID 135432741
N-(indol-3-ylidenemethyl)pyridine-4-carbohydrazide
CID 53431953

Frequently Asked Questions

What is the IUPAC name of (3Z)-3-(2-phenylethylidene)indole?
The IUPAC name of (3Z)-3-(2-phenylethylidene)indole (CID 135017063) is (3Z)-3-(2-phenylethylidene)indole.
What is the SMILES notation for (3Z)-3-(2-phenylethylidene)indole?
The canonical SMILES for (3Z)-3-(2-phenylethylidene)indole is C1=Nc2ccccc2/C1=C/Cc1ccccc1.
What is the InChIKey of (3Z)-3-(2-phenylethylidene)indole?
The InChIKey is LQPFZAJKOIPEAN-SDNWHVSQSA-N. The full InChI is InChI=1S/C16H13N/c1-2-6-13(7-3-1)10-11-14-12-17-16-9-5-4-8-15(14)16/h1-9,11-12H,10H2/b14-11+.
What are the key properties of (3Z)-3-(2-phenylethylidene)indole?
(3Z)-3-(2-phenylethylidene)indole has a molecular weight of 219.29 g/mol, XLogP of 4.03, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-3-(2-phenylethylidene)indole is sourced from PubChem (CID 135017063), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).