5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide

C19H13FN4O — CID 109199006

IUPAC5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3)nc2)cc1
InChIInChI=1S/C19H13FN4O/c20-14-3-7-16(8-4-14)24-19(25)18-10-9-17(12-22-18)23-15-5-1-13(11-21)2-6-15/h1-10,12,23H,(H,24,25)
InChIKeyMDUOYFASUIIIKF-UHFFFAOYSA-N
MW332.34 g/mol
LogP4.09
Rot. Bonds4

About 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide

5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide (PubChem CID 109199006) has the molecular formula C19H13FN4O and a molecular weight of 332.34 g/mol. Its IUPAC name is 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
PubChem CID109199006
Molecular FormulaC19H13FN4O
Molecular Weight332.34 g/mol
Exact Mass332.11
IUPAC Name5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
SMILESN#Cc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3)nc2)cc1
InChIInChI=1S/C19H13FN4O/c20-14-3-7-16(8-4-14)24-19(25)18-10-9-17(12-22-18)23-15-5-1-13(11-21)2-6-15/h1-10,12,23H,(H,24,25)
InChIKeyMDUOYFASUIIIKF-UHFFFAOYSA-N
XLogP4.09
TPSA77.81 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.34
LogP ≤ 54.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(4-cyanoanilino)-N-[4-(dimethylamino)phenyl]pyridine-2-carboxamide
CID 109200559
5-(3-chloroanilino)-N-(4-cyanophenyl)pyridine-2-carboxamide
CID 109199236
N-(4-cyanophenyl)-6-(4-fluoroanilino)pyrimidine-4-carboxamide
CID 109357985
5-(4-cyanoanilino)-N-propylpyridine-2-carboxamide
CID 109179230
6-(4-cyanoanilino)-N-(4-fluorophenyl)-2-methylpyrimidine-4-carboxamide
CID 112849979
methyl 4-[[6-[(4-fluorophenyl)carbamoyl]-3-pyridinyl]amino]benzoate
CID 109198978
N-(4-chlorophenyl)-5-cyanopyridine-2-carboxamide
CID 63716705
5-(4-cyanoanilino)-N-cyclohexylpyridine-2-carboxamide
CID 109183058
N-(4-cyanophenyl)-5-[2-(dimethylamino)ethylamino]pyridine-2-carboxamide
CID 109185633
2-(4-cyanoanilino)-N-(4-fluorophenyl)-6-methylpyrimidine-4-carboxamide
CID 109336944
N-(4-cyanophenyl)-5-(2,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294517
5-[4-(diethylamino)anilino]-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198981

Frequently Asked Questions

What is the IUPAC name of 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide (CID 109199006) is 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide is N#Cc1ccc(Nc2ccc(C(=O)Nc3ccc(F)cc3)nc2)cc1.
What is the InChIKey of 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide?
The InChIKey is MDUOYFASUIIIKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H13FN4O/c20-14-3-7-16(8-4-14)24-19(25)18-10-9-17(12-22-18)23-15-5-1-13(11-21)2-6-15/h1-10,12,23H,(H,24,25).
What are the key properties of 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide?
5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide has a molecular weight of 332.34 g/mol, XLogP of 4.09, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-cyanoanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109199006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).