N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide

C17H10Cl2F2N4O — CID 109294564

IUPACN-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1cnc(Nc2ccc(F)c(F)c2)cn1
InChIInChI=1S/C17H10Cl2F2N4O/c18-11-3-1-9(5-12(11)19)25-17(26)15-7-23-16(8-22-15)24-10-2-4-13(20)14(21)6-10/h1-8H,(H,23,24)(H,25,26)
InChIKeyROHQFCDOPSIDIV-UHFFFAOYSA-N
MW395.20 g/mol
LogP5.06
Rot. Bonds4

About N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide

N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide (PubChem CID 109294564) has the molecular formula C17H10Cl2F2N4O and a molecular weight of 395.20 g/mol. Its IUPAC name is N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide
PubChem CID109294564
Molecular FormulaC17H10Cl2F2N4O
Molecular Weight395.20 g/mol
Exact Mass394.02
IUPAC NameN-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide
SMILESO=C(Nc1ccc(Cl)c(Cl)c1)c1cnc(Nc2ccc(F)c(F)c2)cn1
InChIInChI=1S/C17H10Cl2F2N4O/c18-11-3-1-9(5-12(11)19)25-17(26)15-7-23-16(8-22-15)24-10-2-4-13(20)14(21)6-10/h1-8H,(H,23,24)(H,25,26)
InChIKeyROHQFCDOPSIDIV-UHFFFAOYSA-N
XLogP5.06
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500395.20
LogP ≤ 55.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294588
5-(2,6-dichloroanilino)-N-(3,4-difluorophenyl)pyrazine-2-carboxamide
CID 109294618
5-(3,4-difluoroanilino)-N-(4-methylphenyl)pyrazine-2-carboxamide
CID 109290108
N-(3,4-dichlorophenyl)-5-(2-fluoroanilino)pyrazine-2-carboxamide
CID 109292450
5-(3,4-dichloroanilino)-N-(2,4-difluorophenyl)pyrazine-2-carboxamide
CID 109294492
5-(3-chloro-4-methylanilino)-N-(4-fluorophenyl)pyrazine-2-carboxamide
CID 109292474
5-(2-chloroanilino)-N-(3-chloro-4-fluorophenyl)pyrazine-2-carboxamide
CID 109292662
N-(3-chloro-4-fluorophenyl)-5-(2,3,4-trifluoroanilino)pyrazine-2-carboxamide
CID 109293212
5-(3-chloro-4-methylanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109293178
5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293597
2-(3,4-dichloroanilino)-N-(3,4-difluorophenyl)pyrimidine-5-carboxamide
CID 109270604
5-(3,4-difluoroanilino)-N-(3,4-difluorophenyl)pyridine-2-carboxamide
CID 109200977

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide (CID 109294564) is N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide is O=C(Nc1ccc(Cl)c(Cl)c1)c1cnc(Nc2ccc(F)c(F)c2)cn1.
What is the InChIKey of N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide?
The InChIKey is ROHQFCDOPSIDIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10Cl2F2N4O/c18-11-3-1-9(5-12(11)19)25-17(26)15-7-23-16(8-22-15)24-10-2-4-13(20)14(21)6-10/h1-8H,(H,23,24)(H,25,26).
What are the key properties of N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide?
N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide has a molecular weight of 395.20 g/mol, XLogP of 5.06, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dichlorophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109294564), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).