N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide

C20H16FN3O — CID 113031771

IUPACN-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide
SMILESO=C(Nc1ccc(N2CCc3ccccc32)cn1)c1ccc(F)cc1
InChIInChI=1S/C20H16FN3O/c21-16-7-5-15(6-8-16)20(25)23-19-10-9-17(13-22-19)24-12-11-14-3-1-2-4-18(14)24/h1-10,13H,11-12H2,(H,22,23,25)
InChIKeyNUKVJAKDZYRREI-UHFFFAOYSA-N
MW333.37 g/mol
LogP4.17
Rot. Bonds3

About N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide

N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide (PubChem CID 113031771) has the molecular formula C20H16FN3O and a molecular weight of 333.37 g/mol. Its IUPAC name is N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide.

Molecular Properties

Compound NameN-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide
PubChem CID113031771
Molecular FormulaC20H16FN3O
Molecular Weight333.37 g/mol
Exact Mass333.13
IUPAC NameN-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide
SMILESO=C(Nc1ccc(N2CCc3ccccc32)cn1)c1ccc(F)cc1
InChIInChI=1S/C20H16FN3O/c21-16-7-5-15(6-8-16)20(25)23-19-10-9-17(13-22-19)24-12-11-14-3-1-2-4-18(14)24/h1-10,13H,11-12H2,(H,22,23,25)
InChIKeyNUKVJAKDZYRREI-UHFFFAOYSA-N
XLogP4.17
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.37
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]furan-2-carboxamide
CID 113031763
N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-4-fluorobenzamide
CID 113046140
N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113031800
4-fluoro-N-[5-(4-pyridin-2-ylpiperazin-1-yl)-2-pyridinyl]benzamide
CID 113029575
N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide
CID 113031855
N-[5-[4-(2-fluorophenyl)piperazin-1-yl]-2-pyridinyl]benzamide
CID 113029474
N-[4-(2,3-dihydroindol-1-yl)phenyl]-3-fluorobenzamide
CID 112986182
5-(2,3-dihydroindol-1-yl)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 109197827
N-[5-(2-ethylpiperidin-1-yl)-2-pyridinyl]-4-fluorobenzamide
CID 113030675
4-(2,3-dihydroindole-1-carbonyl)-N-(4-fluorophenyl)benzamide
CID 109049539
N-(3-acetamidophenyl)-5-(2,3-dihydroindol-1-yl)pyridine-2-carboxamide
CID 109197843
5-(2,3-dihydroindol-1-yl)-N-(2-ethoxyphenyl)pyridine-2-carboxamide
CID 109197830

Frequently Asked Questions

What is the IUPAC name of N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide?
The IUPAC name of N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide (CID 113031771) is N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide.
What is the SMILES notation for N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide?
The canonical SMILES for N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide is O=C(Nc1ccc(N2CCc3ccccc32)cn1)c1ccc(F)cc1.
What is the InChIKey of N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide?
The InChIKey is NUKVJAKDZYRREI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16FN3O/c21-16-7-5-15(6-8-16)20(25)23-19-10-9-17(13-22-19)24-12-11-14-3-1-2-4-18(14)24/h1-10,13H,11-12H2,(H,22,23,25).
What are the key properties of N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide?
N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide has a molecular weight of 333.37 g/mol, XLogP of 4.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-4-fluorobenzamide is sourced from PubChem (CID 113031771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).