N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide

C19H22N4O2 — CID 109274951

IUPACN-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cnc(NC3CCCCC3)cn2)cc1
InChIInChI=1S/C19H22N4O2/c1-13(24)14-7-9-16(10-8-14)23-19(25)17-11-21-18(12-20-17)22-15-5-3-2-4-6-15/h7-12,15H,2-6H2,1H3,(H,21,22)(H,23,25)
InChIKeyGRNIZHTVRIAMCH-UHFFFAOYSA-N
MW338.41 g/mol
LogP3.68
Rot. Bonds5

About N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide

N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide (PubChem CID 109274951) has the molecular formula C19H22N4O2 and a molecular weight of 338.41 g/mol. Its IUPAC name is N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide
PubChem CID109274951
Molecular FormulaC19H22N4O2
Molecular Weight338.41 g/mol
Exact Mass338.17
IUPAC NameN-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide
SMILESCC(=O)c1ccc(NC(=O)c2cnc(NC3CCCCC3)cn2)cc1
InChIInChI=1S/C19H22N4O2/c1-13(24)14-7-9-16(10-8-14)23-19(25)17-11-21-18(12-20-17)22-15-5-3-2-4-6-15/h7-12,15H,2-6H2,1H3,(H,21,22)(H,23,25)
InChIKeyGRNIZHTVRIAMCH-UHFFFAOYSA-N
XLogP3.68
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.41
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-acetylphenyl)-5-(cyclopentylamino)pyrazine-2-carboxamide
CID 109274207
N-(4-acetamidophenyl)-5-(cyclopentylamino)pyrazine-2-carboxamide
CID 109274209
5-(cyclohexylamino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109274938
5-(cycloheptylamino)-N-(4-pyrrolidin-1-ylphenyl)pyrazine-2-carboxamide
CID 109287624
N-(4-acetylphenyl)-6-(cycloheptylamino)-2-methylpyrimidine-4-carboxamide
CID 109373944
5-(cyclopropylamino)-N-[4-(dimethylamino)phenyl]pyrazine-2-carboxamide
CID 109271899
5-(cyclohexylamino)-N-(3-methylphenyl)pyrazine-2-carboxamide
CID 109274899
5-(cyclopentylamino)-N-(3,5-dimethylphenyl)pyrazine-2-carboxamide
CID 109274163
5-(cyclopropylamino)-N-[4-(trifluoromethyl)phenyl]pyrazine-2-carboxamide
CID 109271889
N-(3-bromophenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274970
N-cyclohexyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274635
N-cycloheptyl-5-(cyclohexylamino)pyrazine-2-carboxamide
CID 109274884

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide?
The IUPAC name of N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide (CID 109274951) is N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide?
The canonical SMILES for N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide is CC(=O)c1ccc(NC(=O)c2cnc(NC3CCCCC3)cn2)cc1.
What is the InChIKey of N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide?
The InChIKey is GRNIZHTVRIAMCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N4O2/c1-13(24)14-7-9-16(10-8-14)23-19(25)17-11-21-18(12-20-17)22-15-5-3-2-4-6-15/h7-12,15H,2-6H2,1H3,(H,21,22)(H,23,25).
What are the key properties of N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide?
N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide has a molecular weight of 338.41 g/mol, XLogP of 3.68, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-5-(cyclohexylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 109274951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).