2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone

C22H19NO — CID 139234692

IUPAC2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone
SMILESO=C(c1ccccc1)C(c1ccccc1)N1CCc2ccccc21
InChIInChI=1S/C22H19NO/c24-22(19-12-5-2-6-13-19)21(18-10-3-1-4-11-18)23-16-15-17-9-7-8-14-20(17)23/h1-14,21H,15-16H2
InChIKeyVFQIULQXKOWRRT-UHFFFAOYSA-N
MW313.40 g/mol
LogP4.67
Rot. Bonds4

About 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone

2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone (PubChem CID 139234692) has the molecular formula C22H19NO and a molecular weight of 313.40 g/mol. Its IUPAC name is 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone.

Molecular Properties

Compound Name2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone
PubChem CID139234692
Molecular FormulaC22H19NO
Molecular Weight313.40 g/mol
Exact Mass313.15
IUPAC Name2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone
SMILESO=C(c1ccccc1)C(c1ccccc1)N1CCc2ccccc21
InChIInChI=1S/C22H19NO/c24-22(19-12-5-2-6-13-19)21(18-10-3-1-4-11-18)23-16-15-17-9-7-8-14-20(17)23/h1-14,21H,15-16H2
InChIKeyVFQIULQXKOWRRT-UHFFFAOYSA-N
XLogP4.67
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.40
LogP ≤ 54.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone 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

(2S)-2-(2,3-dihydroindol-1-yl)-2-(4-fluorophenyl)acetamide
CID 51641515
(2S)-2-[[(2S)-2-(2,3-dihydroindol-1-yl)-2-phenylacetyl]amino]propanamide
CID 124616246
3-[[2-(2,3-dihydroindol-1-yl)-2-phenylacetyl]amino]propanamide
CID 122143195
(2S)-2-[[(2R)-2-(2,3-dihydroindol-1-yl)-2-phenylacetyl]amino]propanamide
CID 124616245
4-(2,3-dihydroindol-1-yl)-4-phenylbutan-2-one
CID 82133752
2-(3,4-dihydro-2H-quinolin-1-yl)-2-(4-hydroxyphenyl)acetic acid
CID 84750442
1-(4-amino-3,3-dimethylpiperidin-1-yl)-2-(2,3-dihydroindol-1-yl)-2-phenylethanone
CID 120818052
1-(4-amino-3,3-dimethylpiperidin-1-yl)-2-(2,3-dihydroindol-1-yl)-2-phenylethanone;dihydrochloride
CID 120818051
(2S)-2-(2,3-dihydroindol-1-yl)-N-[(3S)-2-oxopiperidin-3-yl]-2-phenylacetamide
CID 95326856
2-(2,3-dihydroindol-1-yl)-2-phenylacetonitrile
CID 121255123
2-(2,3-dihydroindol-1-yl)pentan-3-one
CID 64868632
2-(2,3-dihydroindol-1-yl)pentanoic acid
CID 21135037

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone?
The IUPAC name of 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone (CID 139234692) is 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone.
What is the SMILES notation for 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone?
The canonical SMILES for 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone is O=C(c1ccccc1)C(c1ccccc1)N1CCc2ccccc21.
What is the InChIKey of 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone?
The InChIKey is VFQIULQXKOWRRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO/c24-22(19-12-5-2-6-13-19)21(18-10-3-1-4-11-18)23-16-15-17-9-7-8-14-20(17)23/h1-14,21H,15-16H2.
What are the key properties of 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone?
2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone has a molecular weight of 313.40 g/mol, XLogP of 4.67, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydroindol-1-yl)-1,2-diphenylethanone is sourced from PubChem (CID 139234692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).