2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone

C16H14FNO — CID 116596855

IUPAC2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone
SMILESCc1ccc(F)c(C(=O)C2Cc3ccccc3N2)c1
InChIInChI=1S/C16H14FNO/c1-10-6-7-13(17)12(8-10)16(19)15-9-11-4-2-3-5-14(11)18-15/h2-8,15,18H,9H2,1H3
InChIKeyIQKBVRIDMCEUSC-UHFFFAOYSA-N
MW255.29 g/mol
LogP3.35
Rot. Bonds2

About 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone

2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone (PubChem CID 116596855) has the molecular formula C16H14FNO and a molecular weight of 255.29 g/mol. Its IUPAC name is 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone.

Molecular Properties

Compound Name2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone
PubChem CID116596855
Molecular FormulaC16H14FNO
Molecular Weight255.29 g/mol
Exact Mass255.11
IUPAC Name2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone
SMILESCc1ccc(F)c(C(=O)C2Cc3ccccc3N2)c1
InChIInChI=1S/C16H14FNO/c1-10-6-7-13(17)12(8-10)16(19)15-9-11-4-2-3-5-14(11)18-15/h2-8,15,18H,9H2,1H3
InChIKeyIQKBVRIDMCEUSC-UHFFFAOYSA-N
XLogP3.35
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.29
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone 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-amino-4-methylbenzoic acid;(2S)-2,3-dihydro-1H-indole-2-carboxylic acid
CID 160725758
(2S)-N-(4-fluoro-3-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 62813197
(4-chlorophenyl)-(2,3-dihydro-1H-indol-2-yl)methanone
CID 116596841
bis(2,3-dihydro-1H-indol-2-yl)methanone
CID 174436301
azetidin-3-yl-(2-fluoro-5-methylphenyl)methanone
CID 116583692
N-hydroxy-2,3-dihydro-1H-indole-2-carboxamide
CID 77014605
(2S)-N-(5-methyl-2-pyridinyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61148110
1-[(2S)-2,3-dihydro-1H-indol-2-yl]propan-1-one
CID 67580634
N,N-dimethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 18184482
(2S)-N-[(3-fluoro-4-methylphenyl)methyl]-2,3-dihydro-1H-indole-2-carboxamide
CID 61155551
(2S)-N-(2,6-difluorophenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61148995
(2S)-N-(5-chloro-2-methylphenyl)-2,3-dihydro-1H-indole-2-carboxamide
CID 61147929

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone?
The IUPAC name of 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone (CID 116596855) is 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone.
What is the SMILES notation for 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone?
The canonical SMILES for 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone is Cc1ccc(F)c(C(=O)C2Cc3ccccc3N2)c1.
What is the InChIKey of 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone?
The InChIKey is IQKBVRIDMCEUSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FNO/c1-10-6-7-13(17)12(8-10)16(19)15-9-11-4-2-3-5-14(11)18-15/h2-8,15,18H,9H2,1H3.
What are the key properties of 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone?
2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone has a molecular weight of 255.29 g/mol, XLogP of 3.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indol-2-yl-(2-fluoro-5-methylphenyl)methanone is sourced from PubChem (CID 116596855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).