N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide

C22H16F2N2O2 — CID 109049570

IUPACN-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(C(=O)N2CCc3ccccc32)cc1
InChIInChI=1S/C22H16F2N2O2/c23-18-10-9-17(13-19(18)24)25-21(27)15-5-7-16(8-6-15)22(28)26-12-11-14-3-1-2-4-20(14)26/h1-10,13H,11-12H2,(H,25,27)
InChIKeyOASUQTITSOYKGK-UHFFFAOYSA-N
MW378.38 g/mol
LogP4.42
Rot. Bonds3

About N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide

N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide (PubChem CID 109049570) has the molecular formula C22H16F2N2O2 and a molecular weight of 378.38 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
PubChem CID109049570
Molecular FormulaC22H16F2N2O2
Molecular Weight378.38 g/mol
Exact Mass378.12
IUPAC NameN-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1ccc(C(=O)N2CCc3ccccc32)cc1
InChIInChI=1S/C22H16F2N2O2/c23-18-10-9-17(13-19(18)24)25-21(27)15-5-7-16(8-6-15)22(28)26-12-11-14-3-1-2-4-20(14)26/h1-10,13H,11-12H2,(H,25,27)
InChIKeyOASUQTITSOYKGK-UHFFFAOYSA-N
XLogP4.42
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.38
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-(2,3-dihydroindole-1-carbonyl)-N-(4-fluorophenyl)benzamide
CID 109049539
N-(4-acetamidophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049557
N-(3,4-difluorophenyl)-2,3-dihydroindole-1-carboxamide
CID 108991230
4-(2,3-dihydroindole-1-carbonyl)-N-(2,3,4-trifluorophenyl)benzamide
CID 109049568
N-(4-chlorophenyl)-5-(2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
CID 109108143
N-(5-chloro-2-methylphenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049544
N-(4-acetamidophenyl)-3-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109057111
N-(3,4-difluorophenyl)-2-(2,3-dihydroindole-1-carbonyl)cyclopropane-1-carboxamide
CID 109141406
4-(2,3-dihydroindole-1-carbonyl)-N-[(2-fluorophenyl)methyl]benzamide
CID 109047185
N-[4-(2,3-dihydroindole-1-carbonyl)phenyl]furan-2-carboxamide
CID 34818899
4-(2,3-dihydroindole-1-carbonyl)-N-(2,4-dimethylphenyl)benzamide
CID 109049527
(3,5-difluorophenyl)-(2,3-dihydroindol-1-yl)methanone
CID 4815727

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide?
The IUPAC name of N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide (CID 109049570) is N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide?
The canonical SMILES for N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide is O=C(Nc1ccc(F)c(F)c1)c1ccc(C(=O)N2CCc3ccccc32)cc1.
What is the InChIKey of N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide?
The InChIKey is OASUQTITSOYKGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16F2N2O2/c23-18-10-9-17(13-19(18)24)25-21(27)15-5-7-16(8-6-15)22(28)26-12-11-14-3-1-2-4-20(14)26/h1-10,13H,11-12H2,(H,25,27).
What are the key properties of N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide?
N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide has a molecular weight of 378.38 g/mol, XLogP of 4.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide is sourced from PubChem (CID 109049570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).