5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide

C22H24N4O — CID 109290316

IUPAC5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cnc(N(C)c2ccccc2)cn1
InChIInChI=1S/C22H24N4O/c1-15(2)18-12-8-9-16(3)21(18)25-22(27)19-13-24-20(14-23-19)26(4)17-10-6-5-7-11-17/h5-15H,1-4H3,(H,25,27)
InChIKeyHRDPZFSRXUXRQJ-UHFFFAOYSA-N
MW360.46 g/mol
LogP4.93
Rot. Bonds5

About 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide

5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide (PubChem CID 109290316) has the molecular formula C22H24N4O and a molecular weight of 360.46 g/mol. Its IUPAC name is 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
PubChem CID109290316
Molecular FormulaC22H24N4O
Molecular Weight360.46 g/mol
Exact Mass360.20
IUPAC Name5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
SMILESCc1cccc(C(C)C)c1NC(=O)c1cnc(N(C)c2ccccc2)cn1
InChIInChI=1S/C22H24N4O/c1-15(2)18-12-8-9-16(3)21(18)25-22(27)19-13-24-20(14-23-19)26(4)17-10-6-5-7-11-17/h5-15H,1-4H3,(H,25,27)
InChIKeyHRDPZFSRXUXRQJ-UHFFFAOYSA-N
XLogP4.93
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.46
LogP ≤ 54.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(N-methylanilino)-N-(2-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109290312
N-(2-ethyl-6-methylphenyl)-5-(N-methylanilino)pyrazine-2-carboxamide
CID 109290311
5-(diethylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109286891
2-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109314201
5-(N-methylanilino)-N-phenylpyrazine-2-carboxamide
CID 109289424
5-hydrazinyl-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 107377417
2-N,5-N-bis(2-methyl-6-propan-2-ylphenyl)pyridine-2,5-dicarboxamide
CID 1312773
5-(diethylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
CID 109194754
5-(butan-2-ylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109273413
5-(cyclopentylamino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide
CID 109274174
N-[4-(diethylamino)phenyl]-5-(N-methylanilino)pyrazine-2-carboxamide
CID 109290357
6-fluoro-N-(2-methyl-6-propan-2-ylphenyl)pyridine-2-carboxamide
CID 115496693

Frequently Asked Questions

What is the IUPAC name of 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide (CID 109290316) is 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide is Cc1cccc(C(C)C)c1NC(=O)c1cnc(N(C)c2ccccc2)cn1.
What is the InChIKey of 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide?
The InChIKey is HRDPZFSRXUXRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O/c1-15(2)18-12-8-9-16(3)21(18)25-22(27)19-13-24-20(14-23-19)26(4)17-10-6-5-7-11-17/h5-15H,1-4H3,(H,25,27).
What are the key properties of 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide?
5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide has a molecular weight of 360.46 g/mol, XLogP of 4.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(N-methylanilino)-N-(2-methyl-6-propan-2-ylphenyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109290316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).