5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide

C19H18N4O3 — CID 109289572

IUPAC5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cnc(Nc3ccccc3)cn2)c1
InChIInChI=1S/C19H18N4O3/c1-25-14-8-9-17(26-2)15(10-14)23-19(24)16-11-21-18(12-20-16)22-13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22)(H,23,24)
InChIKeyWWCPYCIWQUXOOM-UHFFFAOYSA-N
MW350.38 g/mol
LogP3.49
Rot. Bonds6

About 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide

5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide (PubChem CID 109289572) has the molecular formula C19H18N4O3 and a molecular weight of 350.38 g/mol. Its IUPAC name is 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide
PubChem CID109289572
Molecular FormulaC19H18N4O3
Molecular Weight350.38 g/mol
Exact Mass350.14
IUPAC Name5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide
SMILESCOc1ccc(OC)c(NC(=O)c2cnc(Nc3ccccc3)cn2)c1
InChIInChI=1S/C19H18N4O3/c1-25-14-8-9-17(26-2)15(10-14)23-19(24)16-11-21-18(12-20-16)22-13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22)(H,23,24)
InChIKeyWWCPYCIWQUXOOM-UHFFFAOYSA-N
XLogP3.49
TPSA85.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500350.38
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-anilino-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109289569
N-(2,5-dimethoxyphenyl)-5-(methylamino)pyrazine-2-carboxamide
CID 107374016
5-(1,3-benzodioxol-5-ylamino)-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109293894
5-(2,5-dimethoxyanilino)-N-(3-fluorophenyl)pyrazine-2-carboxamide
CID 109293907
5-(2,4-difluoroanilino)-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109293895
5-(2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)pyrazine-2-carboxamide
CID 109291247
N-(2,4-dimethoxyphenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109293921
5-(4-cyanoanilino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109293927
N-(3-chloro-2-methylphenyl)-5-(2,5-dimethoxyanilino)pyrazine-2-carboxamide
CID 109292936
5-(5-chloro-2-methoxyanilino)-N-phenylpyrazine-2-carboxamide
CID 109289456
5-(2,5-dimethoxyanilino)-N-(2,4-dimethylphenyl)pyrazine-2-carboxamide
CID 109290731
5-(3-acetylanilino)-N-(2,4-dimethoxyphenyl)pyrazine-2-carboxamide
CID 109293918

Frequently Asked Questions

What is the IUPAC name of 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide (CID 109289572) is 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide is COc1ccc(OC)c(NC(=O)c2cnc(Nc3ccccc3)cn2)c1.
What is the InChIKey of 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide?
The InChIKey is WWCPYCIWQUXOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O3/c1-25-14-8-9-17(26-2)15(10-14)23-19(24)16-11-21-18(12-20-16)22-13-6-4-3-5-7-13/h3-12H,1-2H3,(H,21,22)(H,23,24).
What are the key properties of 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide?
5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide has a molecular weight of 350.38 g/mol, XLogP of 3.49, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-anilino-N-(2,5-dimethoxyphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109289572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).