N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide

C23H26N4O2 — CID 109292218

IUPACN-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cnc(Nc2c(C)cccc2C(C)C)cn1
InChIInChI=1S/C23H26N4O2/c1-14(2)17-8-6-7-16(4)22(17)27-21-13-24-19(12-25-21)23(28)26-18-11-15(3)9-10-20(18)29-5/h6-14H,1-5H3,(H,25,27)(H,26,28)
InChIKeyXUYKFRUZMBFOMW-UHFFFAOYSA-N
MW390.49 g/mol
LogP5.22
Rot. Bonds6

About N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide

N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide (PubChem CID 109292218) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide
PubChem CID109292218
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide
SMILESCOc1ccc(C)cc1NC(=O)c1cnc(Nc2c(C)cccc2C(C)C)cn1
InChIInChI=1S/C23H26N4O2/c1-14(2)17-8-6-7-16(4)22(17)27-21-13-24-19(12-25-21)23(28)26-18-11-15(3)9-10-20(18)29-5/h6-14H,1-5H3,(H,25,27)(H,26,28)
InChIKeyXUYKFRUZMBFOMW-UHFFFAOYSA-N
XLogP5.22
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.49
LogP ≤ 55.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-methoxy-5-methylphenyl)-2-(2-methyl-6-propan-2-ylanilino)pyrimidine-5-carboxamide
CID 109268180
N-(2-methoxy-5-methylphenyl)-5-(4-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109292055
N-(2-ethyl-6-methylphenyl)-5-(2-methoxy-5-methylanilino)pyrazine-2-carboxamide
CID 109291856
5-anilino-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109289569
5-(2-methoxy-5-methylanilino)-N-(2-methoxyphenyl)pyrazine-2-carboxamide
CID 109293379
5-(2-chloroanilino)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109292670
5-(2,6-dimethylanilino)-N-(2-methoxy-5-methylphenyl)pyridine-2-carboxamide
CID 109198259
5-(3-acetylanilino)-N-(2-methoxy-5-methylphenyl)pyrazine-2-carboxamide
CID 109293781
5-(3-methoxyanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109292193
N-(2-chlorophenyl)-5-(2-methoxy-5-methylanilino)pyrazine-2-carboxamide
CID 109292615
5-(2,5-dimethoxyanilino)-N-(2,6-dimethylphenyl)pyrazine-2-carboxamide
CID 109291247
5-(2-methoxy-5-methylanilino)-N-(4-propan-2-yloxyphenyl)pyrazine-2-carboxamide
CID 109293804

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide (CID 109292218) is N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide is COc1ccc(C)cc1NC(=O)c1cnc(Nc2c(C)cccc2C(C)C)cn1.
What is the InChIKey of N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide?
The InChIKey is XUYKFRUZMBFOMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-14(2)17-8-6-7-16(4)22(17)27-21-13-24-19(12-25-21)23(28)26-18-11-15(3)9-10-20(18)29-5/h6-14H,1-5H3,(H,25,27)(H,26,28).
What are the key properties of N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide?
N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 5.22, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxy-5-methylphenyl)-5-(2-methyl-6-propan-2-ylanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109292218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).