N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide

C19H15N5O2 — CID 109293558

IUPACN-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
SMILESCOc1cccc(Nc2cnc(C(=O)Nc3ccccc3C#N)cn2)c1
InChIInChI=1S/C19H15N5O2/c1-26-15-7-4-6-14(9-15)23-18-12-21-17(11-22-18)19(25)24-16-8-3-2-5-13(16)10-20/h2-9,11-12H,1H3,(H,22,23)(H,24,25)
InChIKeyXGYZQKBMAPBHPZ-UHFFFAOYSA-N
MW345.36 g/mol
LogP3.35
Rot. Bonds5

About N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide

N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide (PubChem CID 109293558) has the molecular formula C19H15N5O2 and a molecular weight of 345.36 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
PubChem CID109293558
Molecular FormulaC19H15N5O2
Molecular Weight345.36 g/mol
Exact Mass345.12
IUPAC NameN-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
SMILESCOc1cccc(Nc2cnc(C(=O)Nc3ccccc3C#N)cn2)c1
InChIInChI=1S/C19H15N5O2/c1-26-15-7-4-6-14(9-15)23-18-12-21-17(11-22-18)19(25)24-16-8-3-2-5-13(16)10-20/h2-9,11-12H,1H3,(H,22,23)(H,24,25)
InChIKeyXGYZQKBMAPBHPZ-UHFFFAOYSA-N
XLogP3.35
TPSA99.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.36
LogP ≤ 53.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

methyl 2-[[5-(3-methoxyanilino)pyrazine-2-carbonyl]amino]benzoate
CID 109293535
5-(3-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293523
5-(2-cyanoanilino)-N-(2-cyanophenyl)pyrazine-2-carboxamide
CID 109294656
N-(2-cyanophenyl)-5-(3,4-difluoroanilino)pyrazine-2-carboxamide
CID 109294662
N-(2-cyanophenyl)-2-(3-methoxyanilino)-6-methylpyrimidine-4-carboxamide
CID 109337510
N-(4-acetamidophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109293534
N-(3-chlorophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109292721
3-N-(2-cyanophenyl)-1-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057632
N-(3,4-dimethylphenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide
CID 109290986
5-(3,5-dimethylanilino)-N-(3-methoxyphenyl)pyrazine-2-carboxamide
CID 109291177
N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide
CID 109291580
5-(2-bromoanilino)-N-(2-cyanophenyl)pyrazine-2-carboxamide
CID 109294390

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide (CID 109293558) is N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide is COc1cccc(Nc2cnc(C(=O)Nc3ccccc3C#N)cn2)c1.
What is the InChIKey of N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide?
The InChIKey is XGYZQKBMAPBHPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5O2/c1-26-15-7-4-6-14(9-15)23-18-12-21-17(11-22-18)19(25)24-16-8-3-2-5-13(16)10-20/h2-9,11-12H,1H3,(H,22,23)(H,24,25).
What are the key properties of N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide?
N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide has a molecular weight of 345.36 g/mol, XLogP of 3.35, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-(3-methoxyanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109293558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).