N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide

C19H18N4O2 — CID 109289766

IUPACN-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc(Nc3ccccc3C)cn2)cc1
InChIInChI=1S/C19H18N4O2/c1-13-5-3-4-6-16(13)23-18-12-20-17(11-21-18)19(24)22-14-7-9-15(25-2)10-8-14/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyMVSJFJBHXNQHLB-UHFFFAOYSA-N
MW334.38 g/mol
LogP3.79
Rot. Bonds5

About N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide

N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide (PubChem CID 109289766) has the molecular formula C19H18N4O2 and a molecular weight of 334.38 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide
PubChem CID109289766
Molecular FormulaC19H18N4O2
Molecular Weight334.38 g/mol
Exact Mass334.14
IUPAC NameN-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide
SMILESCOc1ccc(NC(=O)c2cnc(Nc3ccccc3C)cn2)cc1
InChIInChI=1S/C19H18N4O2/c1-13-5-3-4-6-16(13)23-18-12-20-17(11-21-18)19(24)22-14-7-9-15(25-2)10-8-14/h3-12H,1-2H3,(H,21,23)(H,22,24)
InChIKeyMVSJFJBHXNQHLB-UHFFFAOYSA-N
XLogP3.79
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.38
LogP ≤ 53.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(dimethylamino)phenyl]-5-(2-methylanilino)pyrazine-2-carboxamide
CID 109289786
5-(3-chloro-4-methylanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293161
5-(2,3-dimethylanilino)-N-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 109291428
5-(4-methoxyanilino)-N-(2-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293616
5-hydrazinyl-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 107377590
5-(4-methoxyanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109291932
5-(3,4-dichloroanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109293597
N-(4-ethoxyphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
CID 109293614
methyl 4-[[5-(4-methoxyanilino)pyrazine-2-carbonyl]amino]benzoate
CID 109293630
methyl 4-[[5-[(2-methylphenyl)carbamoyl]pyrazin-2-yl]amino]benzoate
CID 109289688
5-anilino-N-(2-methylphenyl)pyrazine-2-carboxamide
CID 109289526
N-(2,4-dimethylphenyl)-5-(4-methoxyanilino)pyrazine-2-carboxamide
CID 109290725

Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide (CID 109289766) is N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide is COc1ccc(NC(=O)c2cnc(Nc3ccccc3C)cn2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide?
The InChIKey is MVSJFJBHXNQHLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N4O2/c1-13-5-3-4-6-16(13)23-18-12-20-17(11-21-18)19(24)22-14-7-9-15(25-2)10-8-14/h3-12H,1-2H3,(H,21,23)(H,22,24).
What are the key properties of N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide?
N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide has a molecular weight of 334.38 g/mol, XLogP of 3.79, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-5-(2-methylanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109289766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).