N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide

C20H20N4O — CID 109290118

IUPACN-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide
SMILESCc1ccc(Nc2cnc(C(=O)Nc3cccc(C)c3C)cn2)cc1
InChIInChI=1S/C20H20N4O/c1-13-7-9-16(10-8-13)23-19-12-21-18(11-22-19)20(25)24-17-6-4-5-14(2)15(17)3/h4-12H,1-3H3,(H,22,23)(H,24,25)
InChIKeyOKSJZPSFHCAXLG-UHFFFAOYSA-N
MW332.41 g/mol
LogP4.40
Rot. Bonds4

About N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide

N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide (PubChem CID 109290118) has the molecular formula C20H20N4O and a molecular weight of 332.41 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide
PubChem CID109290118
Molecular FormulaC20H20N4O
Molecular Weight332.41 g/mol
Exact Mass332.16
IUPAC NameN-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide
SMILESCc1ccc(Nc2cnc(C(=O)Nc3cccc(C)c3C)cn2)cc1
InChIInChI=1S/C20H20N4O/c1-13-7-9-16(10-8-13)23-19-12-21-18(11-22-19)20(25)24-17-6-4-5-14(2)15(17)3/h4-12H,1-3H3,(H,22,23)(H,24,25)
InChIKeyOKSJZPSFHCAXLG-UHFFFAOYSA-N
XLogP4.40
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(3-bromoanilino)-N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 109291389
N-(2,3-dimethylphenyl)-5-(3-fluoroanilino)pyrazine-2-carboxamide
CID 109291387
5-anilino-N-(2-methylphenyl)pyrazine-2-carboxamide
CID 109289526
5-(1,3-benzodioxol-5-ylamino)-N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 109291390
5-(4-methylanilino)-N-phenylpyrazine-2-carboxamide
CID 109289423
N-(2-chlorophenyl)-5-(2,3-dimethylanilino)pyrazine-2-carboxamide
CID 109291413
5-(4-methylanilino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109289825
5-(3-methylanilino)-N-(2-methylphenyl)pyrazine-2-carboxamide
CID 109289632
N-(4-chloro-2-methylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide
CID 109290136
N-(2,3-dimethylphenyl)-5-methylpyrazine-2-carboxamide
CID 16613943
5-(2,3-dimethylanilino)-N-(2-ethylphenyl)pyrazine-2-carboxamide
CID 109291406
5-(cyclopropylamino)-N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 109271849

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide (CID 109290118) is N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide is Cc1ccc(Nc2cnc(C(=O)Nc3cccc(C)c3C)cn2)cc1.
What is the InChIKey of N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide?
The InChIKey is OKSJZPSFHCAXLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N4O/c1-13-7-9-16(10-8-13)23-19-12-21-18(11-22-19)20(25)24-17-6-4-5-14(2)15(17)3/h4-12H,1-3H3,(H,22,23)(H,24,25).
What are the key properties of N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide?
N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide has a molecular weight of 332.41 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-5-(4-methylanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109290118), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).