2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide

C19H15F2N3O — CID 51107830

IUPAC2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide
SMILESO=C(Nc1ccc(NCc2ccccn2)cc1)c1ccc(F)cc1F
InChIInChI=1S/C19H15F2N3O/c20-13-4-9-17(18(21)11-13)19(25)24-15-7-5-14(6-8-15)23-12-16-3-1-2-10-22-16/h1-11,23H,12H2,(H,24,25)
InChIKeyOMGPMKXNKNEETP-UHFFFAOYSA-N
MW339.35 g/mol
LogP4.22
Rot. Bonds5

About 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide

2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide (PubChem CID 51107830) has the molecular formula C19H15F2N3O and a molecular weight of 339.35 g/mol. Its IUPAC name is 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide.

Molecular Properties

Compound Name2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide
PubChem CID51107830
Molecular FormulaC19H15F2N3O
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC Name2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide
SMILESO=C(Nc1ccc(NCc2ccccn2)cc1)c1ccc(F)cc1F
InChIInChI=1S/C19H15F2N3O/c20-13-4-9-17(18(21)11-13)19(25)24-15-7-5-14(6-8-15)23-12-16-3-1-2-10-22-16/h1-11,23H,12H2,(H,24,25)
InChIKeyOMGPMKXNKNEETP-UHFFFAOYSA-N
XLogP4.22
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-difluoro-N-(pyridin-2-ylmethyl)benzamide
CID 9414595
N-(2,4-difluorophenyl)-5-(pyridin-2-ylmethylamino)pyridine-2-carboxamide
CID 109191145
2,4-difluoro-N-(2-pyridin-2-ylethyl)benzamide
CID 51164132
3,4-difluoro-N-[5-(pyridin-2-ylmethylamino)-2-pyridinyl]benzamide
CID 113027675
2,4-difluoro-N-[4-(pyridin-2-ylsulfamoyl)phenyl]benzamide
CID 53257051
2,4-difluoro-N-[4-[[6-(pyridin-2-ylamino)pyrimidin-4-yl]amino]phenyl]benzamide
CID 122315819
N-(4-fluorophenyl)-2-phenyl-6-(pyridin-2-ylmethylamino)pyrimidine-4-carboxamide
CID 112854063
methyl N-[4-(pyridin-2-ylmethylamino)phenyl]carbamate
CID 43730278
N-(3-fluorophenyl)-6-(pyridin-2-ylmethylamino)pyridazine-3-carboxamide
CID 109120764
N-(3,4-difluorophenyl)-5-(pyridin-2-ylmethylamino)pyridine-3-carboxamide
CID 109235200
2-chloro-4-fluoro-N-[3-(pyridin-2-ylmethylcarbamoyl)phenyl]benzamide
CID 55783783
N-[2-[(2,4-difluorobenzoyl)amino]-4-fluorophenyl]pyridine-2-carboxamide
CID 55834647

Frequently Asked Questions

What is the IUPAC name of 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide?
The IUPAC name of 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide (CID 51107830) is 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide.
What is the SMILES notation for 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide?
The canonical SMILES for 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide is O=C(Nc1ccc(NCc2ccccn2)cc1)c1ccc(F)cc1F.
What is the InChIKey of 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide?
The InChIKey is OMGPMKXNKNEETP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N3O/c20-13-4-9-17(18(21)11-13)19(25)24-15-7-5-14(6-8-15)23-12-16-3-1-2-10-22-16/h1-11,23H,12H2,(H,24,25).
What are the key properties of 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide?
2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide has a molecular weight of 339.35 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-difluoro-N-[4-(pyridin-2-ylmethylamino)phenyl]benzamide is sourced from PubChem (CID 51107830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).