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

C20H17F2N3O2 — CID 109245433

IUPACN-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccccc1Nc1cncc(C(=O)Nc2ccc(F)cc2F)c1
InChIInChI=1S/C20H17F2N3O2/c1-2-27-19-6-4-3-5-18(19)24-15-9-13(11-23-12-15)20(26)25-17-8-7-14(21)10-16(17)22/h3-12,24H,2H2,1H3,(H,25,26)
InChIKeyVCMLDFZZKPEARS-UHFFFAOYSA-N
MW369.37 g/mol
LogP4.75
Rot. Bonds6

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

N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide (PubChem CID 109245433) has the molecular formula C20H17F2N3O2 and a molecular weight of 369.37 g/mol. Its IUPAC name is N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
PubChem CID109245433
Molecular FormulaC20H17F2N3O2
Molecular Weight369.37 g/mol
Exact Mass369.13
IUPAC NameN-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
SMILESCCOc1ccccc1Nc1cncc(C(=O)Nc2ccc(F)cc2F)c1
InChIInChI=1S/C20H17F2N3O2/c1-2-27-19-6-4-3-5-18(19)24-15-9-13(11-23-12-15)20(26)25-17-8-7-14(21)10-16(17)22/h3-12,24H,2H2,1H3,(H,25,26)
InChIKeyVCMLDFZZKPEARS-UHFFFAOYSA-N
XLogP4.75
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.37
LogP ≤ 54.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-difluorophenyl)-5-(4-ethoxyanilino)pyridine-3-carboxamide
CID 109245490
ethyl 2-[[5-(2,4-difluoroanilino)pyridine-3-carbonyl]amino]benzoate
CID 109246267
N-(2-ethoxyphenyl)-5-(2-propan-2-yloxyanilino)pyridine-3-carboxamide
CID 109245387
N-(2-tert-butylphenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide
CID 109244010
5-(2-ethoxyanilino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109245416
5-(3,5-dimethylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109243078
5-N-(2,4-difluorophenyl)-3-N-(4-ethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109108941
5-(4-tert-butylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109244073
5-(3,4-dimethylanilino)-N-(2-ethoxyphenyl)pyridine-3-carboxamide
CID 109242967
N-(2,4-difluorophenyl)-5-(2,3,4-trifluoroanilino)pyridine-3-carboxamide
CID 109246256
N-(2,4-difluorophenyl)-5-(2,4-dimethylanilino)pyridine-3-carboxamide
CID 109242767
N-(2,4-difluorophenyl)-5-(3,4-dimethoxyanilino)pyridine-3-carboxamide
CID 109245690

Frequently Asked Questions

What is the IUPAC name of N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide?
The IUPAC name of N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide (CID 109245433) is N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide.
What is the SMILES notation for N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide?
The canonical SMILES for N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide is CCOc1ccccc1Nc1cncc(C(=O)Nc2ccc(F)cc2F)c1.
What is the InChIKey of N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide?
The InChIKey is VCMLDFZZKPEARS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17F2N3O2/c1-2-27-19-6-4-3-5-18(19)24-15-9-13(11-23-12-15)20(26)25-17-8-7-14(21)10-16(17)22/h3-12,24H,2H2,1H3,(H,25,26).
What are the key properties of N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide?
N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide has a molecular weight of 369.37 g/mol, XLogP of 4.75, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-difluorophenyl)-5-(2-ethoxyanilino)pyridine-3-carboxamide is sourced from PubChem (CID 109245433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).