N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide

C24H18FN3O — CID 164589782

IUPACN-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide
SMILESO=C(Nc1cccc(F)c1)c1cccc(Nc2ccc(-c3cccnc3)cc2)c1
InChIInChI=1S/C24H18FN3O/c25-20-6-2-8-23(15-20)28-24(29)18-4-1-7-22(14-18)27-21-11-9-17(10-12-21)19-5-3-13-26-16-19/h1-16,27H,(H,28,29)
InChIKeyPDYWKOILNSRZJP-UHFFFAOYSA-N
MW383.43 g/mol
LogP5.88
Rot. Bonds5

About N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide

N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide (PubChem CID 164589782) has the molecular formula C24H18FN3O and a molecular weight of 383.43 g/mol. Its IUPAC name is N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide
PubChem CID164589782
Molecular FormulaC24H18FN3O
Molecular Weight383.43 g/mol
Exact Mass383.14
IUPAC NameN-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide
SMILESO=C(Nc1cccc(F)c1)c1cccc(Nc2ccc(-c3cccnc3)cc2)c1
InChIInChI=1S/C24H18FN3O/c25-20-6-2-8-23(15-20)28-24(29)18-4-1-7-22(14-18)27-21-11-9-17(10-12-21)19-5-3-13-26-16-19/h1-16,27H,(H,28,29)
InChIKeyPDYWKOILNSRZJP-UHFFFAOYSA-N
XLogP5.88
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500383.43
LogP ≤ 55.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 3-(4-pyridin-3-ylanilino)benzoate
CID 164589559
N-(3-pyridin-3-ylphenyl)pyridine-3-carboxamide
CID 110461666
N-[4-(3-fluoroanilino)phenyl]benzamide
CID 112988934
N-(3-pyridin-3-ylphenyl)-4-pyrimidin-5-ylbenzamide
CID 25058459
N-(3,4-dichlorophenyl)-3-[[5-(3-fluorophenyl)pyrimidin-2-yl]amino]benzamide
CID 164589476
3-fluoro-N-(2-pyridin-3-yl-1,3-benzoxazol-5-yl)benzamide
CID 2996567
3-phenyl-N-pyridin-3-ylbenzamide
CID 110723041
3-acetamido-N-(3-fluorophenyl)benzamide
CID 2443243
1-N,3-N-dipyridin-3-ylbenzene-1,3-dicarboxamide
CID 679756
N-(3,4-dimethoxyphenyl)-3-[[5-(4-fluorophenyl)pyrimidin-2-yl]amino]benzamide
CID 50826559
3-fluoro-N-[5-(3-fluoroanilino)-2-pyridinyl]benzamide
CID 113035868
3-N-(3-fluorophenyl)-1-N-(4-methylphenyl)benzene-1,3-dicarboxamide
CID 109056998

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide?
The IUPAC name of N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide (CID 164589782) is N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide.
What is the SMILES notation for N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide?
The canonical SMILES for N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide is O=C(Nc1cccc(F)c1)c1cccc(Nc2ccc(-c3cccnc3)cc2)c1.
What is the InChIKey of N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide?
The InChIKey is PDYWKOILNSRZJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H18FN3O/c25-20-6-2-8-23(15-20)28-24(29)18-4-1-7-22(14-18)27-21-11-9-17(10-12-21)19-5-3-13-26-16-19/h1-16,27H,(H,28,29).
What are the key properties of N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide?
N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide has a molecular weight of 383.43 g/mol, XLogP of 5.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-3-(4-pyridin-3-ylanilino)benzamide is sourced from PubChem (CID 164589782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).