N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide

C24H21FN2O2 — CID 109054646

IUPACN-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
SMILESCC1Cc2ccccc2N1C(=O)c1cccc(C(=O)NCc2ccccc2F)c1
InChIInChI=1S/C24H21FN2O2/c1-16-13-17-7-3-5-12-22(17)27(16)24(29)19-10-6-9-18(14-19)23(28)26-15-20-8-2-4-11-21(20)25/h2-12,14,16H,13,15H2,1H3,(H,26,28)
InChIKeyJNIFLORJLJZXHC-UHFFFAOYSA-N
MW388.44 g/mol
LogP4.35
Rot. Bonds4

About N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide

N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide (PubChem CID 109054646) has the molecular formula C24H21FN2O2 and a molecular weight of 388.44 g/mol. Its IUPAC name is N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide.

Molecular Properties

Compound NameN-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
PubChem CID109054646
Molecular FormulaC24H21FN2O2
Molecular Weight388.44 g/mol
Exact Mass388.16
IUPAC NameN-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
SMILESCC1Cc2ccccc2N1C(=O)c1cccc(C(=O)NCc2ccccc2F)c1
InChIInChI=1S/C24H21FN2O2/c1-16-13-17-7-3-5-12-22(17)27(16)24(29)19-10-6-9-18(14-19)23(28)26-15-20-8-2-4-11-21(20)25/h2-12,14,16H,13,15H2,1H3,(H,26,28)
InChIKeyJNIFLORJLJZXHC-UHFFFAOYSA-N
XLogP4.35
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 ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-[(4-methylphenyl)methyl]benzamide
CID 109054414
3-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-(2-phenylethyl)benzamide
CID 109055314
3-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-(2-morpholin-4-ylethyl)benzamide
CID 109053349
N-butan-2-yl-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
CID 109051597
3-[(2S)-2-methyl-2,3-dihydroindole-1-carbonyl]benzamide
CID 51729442
N-(3-acetylphenyl)-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
CID 109057702
N-(2-fluorophenyl)-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzenesulfinamide
CID 170977011
N-(2-cyanophenyl)-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
CID 109057792
(3-iodophenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 2943863
(4-amino-3-fluorophenyl)-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 62678879
3-methyl-N-[2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoethyl]benzamide
CID 113001074
N-[2-(2-fluorophenyl)ethyl]-2-(2-methyl-2,3-dihydroindol-1-yl)-2-oxoacetamide
CID 108985287

Frequently Asked Questions

What is the IUPAC name of N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide?
The IUPAC name of N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide (CID 109054646) is N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide.
What is the SMILES notation for N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide?
The canonical SMILES for N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide is CC1Cc2ccccc2N1C(=O)c1cccc(C(=O)NCc2ccccc2F)c1.
What is the InChIKey of N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide?
The InChIKey is JNIFLORJLJZXHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21FN2O2/c1-16-13-17-7-3-5-12-22(17)27(16)24(29)19-10-6-9-18(14-19)23(28)26-15-20-8-2-4-11-21(20)25/h2-12,14,16H,13,15H2,1H3,(H,26,28).
What are the key properties of N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide?
N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide has a molecular weight of 388.44 g/mol, XLogP of 4.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-fluorophenyl)methyl]-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide is sourced from PubChem (CID 109054646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).