N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide

C24H21FN2O2 — CID 175211818

IUPACN-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide
SMILESCCc1cc(F)ccc1C(=O)Nc1ccc2c(c1)CCN2C(=O)c1ccccc1
InChIInChI=1S/C24H21FN2O2/c1-2-16-14-19(25)8-10-21(16)23(28)26-20-9-11-22-18(15-20)12-13-27(22)24(29)17-6-4-3-5-7-17/h3-11,14-15H,2,12-13H2,1H3,(H,26,28)
InChIKeyRYLMJOVRQAPWQT-UHFFFAOYSA-N
MW388.44 g/mol
LogP4.84
Rot. Bonds4

About N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide

N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide (PubChem CID 175211818) has the molecular formula C24H21FN2O2 and a molecular weight of 388.44 g/mol. Its IUPAC name is N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide.

Molecular Properties

Compound NameN-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide
PubChem CID175211818
Molecular FormulaC24H21FN2O2
Molecular Weight388.44 g/mol
Exact Mass388.16
IUPAC NameN-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide
SMILESCCc1cc(F)ccc1C(=O)Nc1ccc2c(c1)CCN2C(=O)c1ccccc1
InChIInChI=1S/C24H21FN2O2/c1-2-16-14-19(25)8-10-21(16)23(28)26-20-9-11-22-18(15-20)12-13-27(22)24(29)17-6-4-3-5-7-17/h3-11,14-15H,2,12-13H2,1H3,(H,26,28)
InChIKeyRYLMJOVRQAPWQT-UHFFFAOYSA-N
XLogP4.84
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.44
LogP ≤ 54.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-benzoyl-3,4-dihydro-2H-quinolin-6-yl)-2-fluorobenzamide
CID 27557625
ethyl 2-[(1-benzoyl-2,3-dihydroindol-5-yl)amino]-2-oxoacetate
CID 112506147
5-benzamido-2,3-dihydroindole-1-carboxylic acid
CID 23147979
N-(1-benzoyl-3,4-dihydro-2H-quinolin-6-yl)butanamide
CID 939823
N-(1-benzoyl-3,4-dihydro-2H-quinolin-6-yl)-2-phenylacetamide
CID 3541809
N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-phenoxyacetamide
CID 112506133
4-(2,3-dihydroindole-1-carbonyl)-N-(4-fluorophenyl)benzamide
CID 109049539
N-(1-benzoyl-3,4-dihydro-2H-quinolin-6-yl)-4-phenylbenzamide
CID 121084310
methyl N-(1-benzoyl-3,4-dihydro-2H-quinolin-6-yl)carbamate
CID 16834631
N-(3,4-difluorophenyl)-4-(2,3-dihydroindole-1-carbonyl)benzamide
CID 109049570
N-[1-(1-benzoyl-2,3-dihydroindol-5-yl)ethyl]-4-fluorobenzamide
CID 175217591
1-(1-benzoyl-2,3-dihydroindol-6-yl)-3-(2,5-difluorophenyl)urea
CID 46384443

Frequently Asked Questions

What is the IUPAC name of N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide?
The IUPAC name of N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide (CID 175211818) is N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide.
What is the SMILES notation for N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide?
The canonical SMILES for N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide is CCc1cc(F)ccc1C(=O)Nc1ccc2c(c1)CCN2C(=O)c1ccccc1.
What is the InChIKey of N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide?
The InChIKey is RYLMJOVRQAPWQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN2O2/c1-2-16-14-19(25)8-10-21(16)23(28)26-20-9-11-22-18(15-20)12-13-27(22)24(29)17-6-4-3-5-7-17/h3-11,14-15H,2,12-13H2,1H3,(H,26,28).
What are the key properties of N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide?
N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide has a molecular weight of 388.44 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzoyl-2,3-dihydroindol-5-yl)-2-ethyl-4-fluorobenzamide is sourced from PubChem (CID 175211818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).