2-benzyl-1,2-dihydrobenzo[e][1]benzofuran

C19H16O — CID 13432982

IUPAC2-benzyl-1,2-dihydrobenzo[e][1]benzofuran
SMILESc1ccc(CC2Cc3c(ccc4ccccc34)O2)cc1
InChIInChI=1S/C19H16O/c1-2-6-14(7-3-1)12-16-13-18-17-9-5-4-8-15(17)10-11-19(18)20-16/h1-11,16H,12-13H2
InChIKeyPBVKUTOTXKDUQD-UHFFFAOYSA-N
MW260.34 g/mol
LogP4.39
Rot. Bonds2

About 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran

2-benzyl-1,2-dihydrobenzo[e][1]benzofuran (PubChem CID 13432982) has the molecular formula C19H16O and a molecular weight of 260.34 g/mol. Its IUPAC name is 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran.

Molecular Properties

Compound Name2-benzyl-1,2-dihydrobenzo[e][1]benzofuran
PubChem CID13432982
Molecular FormulaC19H16O
Molecular Weight260.34 g/mol
Exact Mass260.12
IUPAC Name2-benzyl-1,2-dihydrobenzo[e][1]benzofuran
SMILESc1ccc(CC2Cc3c(ccc4ccccc34)O2)cc1
InChIInChI=1S/C19H16O/c1-2-6-14(7-3-1)12-16-13-18-17-9-5-4-8-15(17)10-11-19(18)20-16/h1-11,16H,12-13H2
InChIKeyPBVKUTOTXKDUQD-UHFFFAOYSA-N
XLogP4.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran 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

1-(1,2-dihydrobenzo[e][1]benzofuran-2-ylmethyl)-4-phenyltriazole
CID 44818765
2-benzyl-2,3-dihydrochromen-4-one
CID 14773508
(2S)-2-benzyl-2,3-dihydro-1-benzofuran-5-carbaldehyde
CID 129362542
(2R)-1,2-dihydrobenzo[e][1]benzofuran-2-carbohydrazide
CID 6933934
N-(2-chloroethyl)-1,2-dihydrobenzo[e][1]benzofuran-2-carboxamide
CID 3472985
2-benzyl-1,2,3,4-tetrahydrobenzo[f]isoquinoline
CID 62721697
11-benzyl-10-oxa-2,3-diazatricyclo[7.3.1.05,13]trideca-1,5(13),6,8-tetraen-4-one
CID 139898997
(4-bromophenyl)-[(2S)-1,2-dihydrobenzo[e][1]benzofuran-2-yl]methanone
CID 162647542
(5S)-5-benzyl-3-naphthalen-1-yl-4,5-dihydro-1,2-oxazole
CID 71561575
3-benzyl-3,4-dihydroisochromen-1-one
CID 10728624
(7-pyrimidin-2-yl-1,2-dihydrobenzo[e][1]benzofuran-2-yl)methanamine
CID 118759553
2-(2,3-dihydro-1H-benzo[f]chromen-3-yl)benzoic acid
CID 56687022

Frequently Asked Questions

What is the IUPAC name of 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran?
The IUPAC name of 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran (CID 13432982) is 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran.
What is the SMILES notation for 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran?
The canonical SMILES for 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran is c1ccc(CC2Cc3c(ccc4ccccc34)O2)cc1.
What is the InChIKey of 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran?
The InChIKey is PBVKUTOTXKDUQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16O/c1-2-6-14(7-3-1)12-16-13-18-17-9-5-4-8-15(17)10-11-19(18)20-16/h1-11,16H,12-13H2.
What are the key properties of 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran?
2-benzyl-1,2-dihydrobenzo[e][1]benzofuran has a molecular weight of 260.34 g/mol, XLogP of 4.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-benzyl-1,2-dihydrobenzo[e][1]benzofuran is sourced from PubChem (CID 13432982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).