N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide

C19H14F3N3O — CID 109233767

IUPACN-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cncc(NCc2ccc(F)cc2)c1
InChIInChI=1S/C19H14F3N3O/c20-14-3-1-12(2-4-14)9-24-16-7-13(10-23-11-16)19(26)25-18-6-5-15(21)8-17(18)22/h1-8,10-11,24H,9H2,(H,25,26)
InChIKeySUAUFFRBSKVSDC-UHFFFAOYSA-N
MW357.34 g/mol
LogP4.36
Rot. Bonds5

About N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide

N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide (PubChem CID 109233767) has the molecular formula C19H14F3N3O and a molecular weight of 357.34 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
PubChem CID109233767
Molecular FormulaC19H14F3N3O
Molecular Weight357.34 g/mol
Exact Mass357.11
IUPAC NameN-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cncc(NCc2ccc(F)cc2)c1
InChIInChI=1S/C19H14F3N3O/c20-14-3-1-12(2-4-14)9-24-16-7-13(10-23-11-16)19(26)25-18-6-5-15(21)8-17(18)22/h1-8,10-11,24H,9H2,(H,25,26)
InChIKeySUAUFFRBSKVSDC-UHFFFAOYSA-N
XLogP4.36
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.34
LogP ≤ 54.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide (CID 109233767) is N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide is O=C(Nc1ccc(F)cc1F)c1cncc(NCc2ccc(F)cc2)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide?
The InChIKey is SUAUFFRBSKVSDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N3O/c20-14-3-1-12(2-4-14)9-24-16-7-13(10-23-11-16)19(26)25-18-6-5-15(21)8-17(18)22/h1-8,10-11,24H,9H2,(H,25,26).
What are the key properties of N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide?
N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide has a molecular weight of 357.34 g/mol, XLogP of 4.36, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-5-[(4-fluorophenyl)methylamino]pyridine-3-carboxamide is sourced from PubChem (CID 109233767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).