N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide

C22H17F2N3O2 — CID 109109041

IUPACN-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1C(=O)c1cncc(C(=O)Nc2ccc(F)cc2F)c1
InChIInChI=1S/C22H17F2N3O2/c1-13-8-14-4-2-3-5-20(14)27(13)22(29)16-9-15(11-25-12-16)21(28)26-19-7-6-17(23)10-18(19)24/h2-7,9-13H,8H2,1H3,(H,26,28)
InChIKeyPGGSCJPUIHDGCA-UHFFFAOYSA-N
MW393.39 g/mol
LogP4.20
Rot. Bonds3

About N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide

N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide (PubChem CID 109109041) has the molecular formula C22H17F2N3O2 and a molecular weight of 393.39 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
PubChem CID109109041
Molecular FormulaC22H17F2N3O2
Molecular Weight393.39 g/mol
Exact Mass393.13
IUPAC NameN-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
SMILESCC1Cc2ccccc2N1C(=O)c1cncc(C(=O)Nc2ccc(F)cc2F)c1
InChIInChI=1S/C22H17F2N3O2/c1-13-8-14-4-2-3-5-20(14)27(13)22(29)16-9-15(11-25-12-16)21(28)26-19-7-6-17(23)10-18(19)24/h2-7,9-13H,8H2,1H3,(H,26,28)
InChIKeyPGGSCJPUIHDGCA-UHFFFAOYSA-N
XLogP4.20
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.39
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,4-difluorophenyl)-4-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-2-carboxamide
CID 109093329
N-(2,5-dimethylphenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide
CID 109108285
N-(2,4-difluorophenyl)-5-(3-methylpiperidine-1-carbonyl)pyridine-3-carboxamide
CID 109107554
[4-(2,4-difluoroanilino)-2-pyridinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109222586
N-(2-cyanophenyl)-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
CID 109057792
N-(4-fluorophenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109244279
[5-(cyclopentylamino)-3-pyridinyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109226236
[2-[(4-fluorophenyl)methylamino]pyrimidin-5-yl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 109257363
N-ethyl-5-(2-methyl-2,3-dihydroindole-1-carbonyl)-N-phenylpyridine-3-carboxamide
CID 109108564
(2-methyl-2,3-dihydroindol-1-yl)-phenylmethanone
CID 15274130
N-(3-acetylphenyl)-3-(2-methyl-2,3-dihydroindole-1-carbonyl)benzamide
CID 109057702
[4-(methylamino)phenyl]-(2-methyl-2,3-dihydroindol-1-yl)methanone
CID 62173307

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide (CID 109109041) is N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide is CC1Cc2ccccc2N1C(=O)c1cncc(C(=O)Nc2ccc(F)cc2F)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide?
The InChIKey is PGGSCJPUIHDGCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F2N3O2/c1-13-8-14-4-2-3-5-20(14)27(13)22(29)16-9-15(11-25-12-16)21(28)26-19-7-6-17(23)10-18(19)24/h2-7,9-13H,8H2,1H3,(H,26,28).
What are the key properties of N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide?
N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide has a molecular weight of 393.39 g/mol, XLogP of 4.20, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-5-(2-methyl-2,3-dihydroindole-1-carbonyl)pyridine-3-carboxamide is sourced from PubChem (CID 109109041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).