N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide

C19H15ClFN3O — CID 109170915

IUPACN-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide
SMILESO=C(NCc1ccc(Cl)cc1)c1ccnc(Nc2cccc(F)c2)c1
InChIInChI=1S/C19H15ClFN3O/c20-15-6-4-13(5-7-15)12-23-19(25)14-8-9-22-18(10-14)24-17-3-1-2-16(21)11-17/h1-11H,12H2,(H,22,24)(H,23,25)
InChIKeyFGOYNOWCXBPEEB-UHFFFAOYSA-N
MW355.80 g/mol
LogP4.55
Rot. Bonds5

About N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide

N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide (PubChem CID 109170915) has the molecular formula C19H15ClFN3O and a molecular weight of 355.80 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide
PubChem CID109170915
Molecular FormulaC19H15ClFN3O
Molecular Weight355.80 g/mol
Exact Mass355.09
IUPAC NameN-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide
SMILESO=C(NCc1ccc(Cl)cc1)c1ccnc(Nc2cccc(F)c2)c1
InChIInChI=1S/C19H15ClFN3O/c20-15-6-4-13(5-7-15)12-23-19(25)14-8-9-22-18(10-14)24-17-3-1-2-16(21)11-17/h1-11H,12H2,(H,22,24)(H,23,25)
InChIKeyFGOYNOWCXBPEEB-UHFFFAOYSA-N
XLogP4.55
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.80
LogP ≤ 54.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-chlorophenyl)methyl]-2-(3-methoxyanilino)pyridine-4-carboxamide
CID 109170897
2-(3-chloro-4-fluoroanilino)-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169934
N-[(4-chlorophenyl)methyl]-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109282066
2-(2,6-difluoroanilino)-N-[(4-fluorophenyl)methyl]pyridine-4-carboxamide
CID 109170627
2-(3,4-difluoroanilino)-N-[(4-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169969
N-[(4-chlorophenyl)methyl]-2-[4-(dimethylamino)anilino]pyridine-4-carboxamide
CID 109170914
N-[(4-chlorophenyl)methyl]-3-[[6-(3-fluorophenyl)pyridazin-3-yl]amino]benzamide
CID 46322466
2-(3-fluoroanilino)-N-(3-phenylpropyl)pyridine-4-carboxamide
CID 109174835
2-(3,4-difluoroanilino)-N-[(3-methylphenyl)methyl]pyridine-4-carboxamide
CID 109169821
2-(3-fluoroanilino)-N-(3-methoxypropyl)pyridine-4-carboxamide
CID 109167115
N-benzyl-2-[(2-chloro-5-fluorobenzoyl)amino]pyridine-4-carboxamide
CID 67153861
N-[(4-chlorophenyl)methyl]-2-[2-(2-fluorophenyl)ethylamino]pyridine-4-carboxamide
CID 109170868

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide (CID 109170915) is N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide is O=C(NCc1ccc(Cl)cc1)c1ccnc(Nc2cccc(F)c2)c1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide?
The InChIKey is FGOYNOWCXBPEEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFN3O/c20-15-6-4-13(5-7-15)12-23-19(25)14-8-9-22-18(10-14)24-17-3-1-2-16(21)11-17/h1-11H,12H2,(H,22,24)(H,23,25).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide?
N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide has a molecular weight of 355.80 g/mol, XLogP of 4.55, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-(3-fluoroanilino)pyridine-4-carboxamide is sourced from PubChem (CID 109170915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).