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

C19H14Cl2FN3O — CID 109170705

IUPACN-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccnc(NCc2ccc(F)cc2)c1
InChIInChI=1S/C19H14Cl2FN3O/c20-16-6-5-15(10-17(16)21)25-19(26)13-7-8-23-18(9-13)24-11-12-1-3-14(22)4-2-12/h1-10H,11H2,(H,23,24)(H,25,26)
InChIKeyAJVNSZBCZXUDIO-UHFFFAOYSA-N
MW390.25 g/mol
LogP5.39
Rot. Bonds5

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

N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide (PubChem CID 109170705) has the molecular formula C19H14Cl2FN3O and a molecular weight of 390.25 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide
PubChem CID109170705
Molecular FormulaC19H14Cl2FN3O
Molecular Weight390.25 g/mol
Exact Mass389.05
IUPAC NameN-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1ccnc(NCc2ccc(F)cc2)c1
InChIInChI=1S/C19H14Cl2FN3O/c20-16-6-5-15(10-17(16)21)25-19(26)13-7-8-23-18(9-13)24-11-12-1-3-14(22)4-2-12/h1-10H,11H2,(H,23,24)(H,25,26)
InChIKeyAJVNSZBCZXUDIO-UHFFFAOYSA-N
XLogP5.39
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.25
LogP ≤ 55.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(diethylamino)phenyl]-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide
CID 109170697
methyl 3-[[2-[(4-fluorophenyl)methylamino]pyridine-4-carbonyl]amino]benzoate
CID 109170694
N-(3,4-dichlorophenyl)-2-(pyridin-2-ylmethylamino)pyridine-4-carboxamide
CID 109171792
2-(1,3-benzodioxol-5-ylmethylamino)-N-(3-chloro-4-fluorophenyl)pyridine-4-carboxamide
CID 109171471
N-(3-chloro-4-fluorophenyl)-2-(ethylamino)pyridine-4-carboxamide
CID 62166984
N-(3-chlorophenyl)-2-[2-(4-fluorophenyl)ethylamino]pyridine-4-carboxamide
CID 109172686
N-(3-acetylphenyl)-2-[(4-chlorophenyl)methylamino]pyridine-4-carboxamide
CID 109170977
4-N-(3-chloro-4-methylphenyl)-2-N-[(4-fluorophenyl)methyl]pyridine-2,4-dicarboxamide
CID 109086609
N-(3-acetamidophenyl)-2-[(4-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109170025
2-[(4-chlorophenyl)methylamino]-N-(2-fluorophenyl)pyridine-4-carboxamide
CID 109170960
2-[(4-chlorophenyl)methylamino]-N-(4-ethoxyphenyl)pyridine-4-carboxamide
CID 109170970
N-(3-chloro-4-fluorophenyl)-2-[(2-methylphenyl)methylamino]pyridine-4-carboxamide
CID 109169709

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide (CID 109170705) is N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1ccnc(NCc2ccc(F)cc2)c1.
What is the InChIKey of N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide?
The InChIKey is AJVNSZBCZXUDIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14Cl2FN3O/c20-16-6-5-15(10-17(16)21)25-19(26)13-7-8-23-18(9-13)24-11-12-1-3-14(22)4-2-12/h1-10H,11H2,(H,23,24)(H,25,26).
What are the key properties of N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide?
N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide has a molecular weight of 390.25 g/mol, XLogP of 5.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-2-[(4-fluorophenyl)methylamino]pyridine-4-carboxamide is sourced from PubChem (CID 109170705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).