4-phenyl-2,3-dihydro-1H-benzo[f]isoindole

C18H15N — CID 132580543

IUPAC4-phenyl-2,3-dihydro-1H-benzo[f]isoindole
SMILESc1ccc(-c2c3c(cc4ccccc24)CNC3)cc1
InChIInChI=1S/C18H15N/c1-2-6-13(7-3-1)18-16-9-5-4-8-14(16)10-15-11-19-12-17(15)18/h1-10,19H,11-12H2
InChIKeyLXJKZAZAEAHQBN-UHFFFAOYSA-N
MW245.33 g/mol
LogP4.11
Rot. Bonds1

About 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole

4-phenyl-2,3-dihydro-1H-benzo[f]isoindole (PubChem CID 132580543) has the molecular formula C18H15N and a molecular weight of 245.33 g/mol. Its IUPAC name is 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole.

Molecular Properties

Compound Name4-phenyl-2,3-dihydro-1H-benzo[f]isoindole
PubChem CID132580543
Molecular FormulaC18H15N
Molecular Weight245.33 g/mol
Exact Mass245.12
IUPAC Name4-phenyl-2,3-dihydro-1H-benzo[f]isoindole
SMILESc1ccc(-c2c3c(cc4ccccc24)CNC3)cc1
InChIInChI=1S/C18H15N/c1-2-6-13(7-3-1)18-16-9-5-4-8-14(16)10-15-11-19-12-17(15)18/h1-10,19H,11-12H2
InChIKeyLXJKZAZAEAHQBN-UHFFFAOYSA-N
XLogP4.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole 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-methyl-4-phenyl-1,3-dihydrobenzo[f]isoindole
CID 12552017
10-bromo-13-azapentacyclo[13.8.0.02,11.03,8.018,23]tricosa-1(15),2(11),3,5,7,9,16,18,20,22-decaene
CID 102339907
4-phenyl-3H-cyclopenta[b]naphthalene
CID 23626827
N-(4-phenyl-2,3-dihydro-1H-isoindol-5-yl)acetamide
CID 130430852
9-(3-anthracen-9-ylphenyl)-10-phenylanthracene
CID 58321138
2,3-dihydro-1H-phenanthro[9,10-c]pyrrole
CID 21493542
4-(4-spiro[1,3-dihydrobenzo[f]isoindol-2-ium-2,1'-azinan-1-ium]-4-ylphenyl)spiro[1,3-dihydrobenzo[f]isoindol-2-ium-2,1'-azinan-1-ium] dibromide
CID 44659271
benzene;2,3-dihydro-1H-isoindole
CID 161490745
6-phenyl-5H-benzo[b]carbazole
CID 10756140
12,19,40,47-tetrazaundecacyclo[47.7.1.12,10.121,29.130,38.03,8.013,18.023,28.031,36.041,46.051,56]hexaconta-1(57),2(60),3,5,7,9,13,15,17,21,23,25,27,29(59),30(58),31,33,35,37,41,43,45,49,51,53,55-hexacosaene-57,58,59,60-tetrol
CID 132570937
CID 175342877
CID 175342877
2-chloro-1,3-diphenylnaphthalene
CID 12697982

Frequently Asked Questions

What is the IUPAC name of 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole?
The IUPAC name of 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole (CID 132580543) is 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole.
What is the SMILES notation for 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole?
The canonical SMILES for 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole is c1ccc(-c2c3c(cc4ccccc24)CNC3)cc1.
What is the InChIKey of 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole?
The InChIKey is LXJKZAZAEAHQBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N/c1-2-6-13(7-3-1)18-16-9-5-4-8-14(16)10-15-11-19-12-17(15)18/h1-10,19H,11-12H2.
What are the key properties of 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole?
4-phenyl-2,3-dihydro-1H-benzo[f]isoindole has a molecular weight of 245.33 g/mol, XLogP of 4.11, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-2,3-dihydro-1H-benzo[f]isoindole is sourced from PubChem (CID 132580543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).