N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide

C20H17F2N3O — CID 109198480

IUPACN-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide
SMILESCCc1ccc(Nc2ccc(C(=O)Nc3ccc(F)c(F)c3)nc2)cc1
InChIInChI=1S/C20H17F2N3O/c1-2-13-3-5-14(6-4-13)24-16-8-10-19(23-12-16)20(26)25-15-7-9-17(21)18(22)11-15/h3-12,24H,2H2,1H3,(H,25,26)
InChIKeySZOHFMPIWYIBRM-UHFFFAOYSA-N
MW353.37 g/mol
LogP4.92
Rot. Bonds5

About N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide

N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide (PubChem CID 109198480) has the molecular formula C20H17F2N3O and a molecular weight of 353.37 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide
PubChem CID109198480
Molecular FormulaC20H17F2N3O
Molecular Weight353.37 g/mol
Exact Mass353.13
IUPAC NameN-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide
SMILESCCc1ccc(Nc2ccc(C(=O)Nc3ccc(F)c(F)c3)nc2)cc1
InChIInChI=1S/C20H17F2N3O/c1-2-13-3-5-14(6-4-13)24-16-8-10-19(23-12-16)20(26)25-15-7-9-17(21)18(22)11-15/h3-12,24H,2H2,1H3,(H,25,26)
InChIKeySZOHFMPIWYIBRM-UHFFFAOYSA-N
XLogP4.92
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.37
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-(3,4-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 109200977
5-(3,4-difluoroanilino)-N-(4-ethoxyphenyl)pyridine-2-carboxamide
CID 109200045
ethyl 4-[[5-(3,4-difluoroanilino)pyridine-2-carbonyl]amino]benzoate
CID 109200789
N-(3,4-difluorophenyl)-6-(4-ethylanilino)pyridine-3-carboxamide
CID 109162873
2-N-(3,4-difluorophenyl)-4-N-(4-ethylphenyl)pyridine-2,4-dicarboxamide
CID 109092288
5-(3,4-difluoroanilino)-N-(3-methoxyphenyl)pyridine-2-carboxamide
CID 109199817
N-(3-chloro-4-fluorophenyl)-5-(4-methylanilino)pyridine-2-carboxamide
CID 109197511
5-(3,4-difluoroanilino)-N-[(4-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109190451
N-(3,4-difluorophenyl)-5-(prop-2-enylamino)pyridine-2-carboxamide
CID 109180618
5-anilino-N-(3-chloro-4-fluorophenyl)pyridine-2-carboxamide
CID 109197085
5-(4-acetylanilino)-N-(3-chloro-4-fluorophenyl)pyridine-2-carboxamide
CID 109199519
5-(aminomethyl)-N-(4-fluoro-3-methylphenyl)pyridine-2-carboxamide
CID 63722889

Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide?
The IUPAC name of N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide (CID 109198480) is N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide?
The canonical SMILES for N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide is CCc1ccc(Nc2ccc(C(=O)Nc3ccc(F)c(F)c3)nc2)cc1.
What is the InChIKey of N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide?
The InChIKey is SZOHFMPIWYIBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O/c1-2-13-3-5-14(6-4-13)24-16-8-10-19(23-12-16)20(26)25-15-7-9-17(21)18(22)11-15/h3-12,24H,2H2,1H3,(H,25,26).
What are the key properties of N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide?
N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide has a molecular weight of 353.37 g/mol, XLogP of 4.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-5-(4-ethylanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109198480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).