N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide

C19H16N4O2 — CID 87001470

IUPACN-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cnccn1
InChIInChI=1S/C19H16N4O2/c1-13-7-8-14(18(24)22-15-5-3-2-4-6-15)11-16(13)23-19(25)17-12-20-9-10-21-17/h2-12H,1H3,(H,22,24)(H,23,25)
InChIKeyLNZZOFJADTYFAR-UHFFFAOYSA-N
MW332.36 g/mol
LogP3.29
Rot. Bonds4

About N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide

N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide (PubChem CID 87001470) has the molecular formula C19H16N4O2 and a molecular weight of 332.36 g/mol. Its IUPAC name is N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide
PubChem CID87001470
Molecular FormulaC19H16N4O2
Molecular Weight332.36 g/mol
Exact Mass332.13
IUPAC NameN-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide
SMILESCc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cnccn1
InChIInChI=1S/C19H16N4O2/c1-13-7-8-14(18(24)22-15-5-3-2-4-6-15)11-16(13)23-19(25)17-12-20-9-10-21-17/h2-12H,1H3,(H,22,24)(H,23,25)
InChIKeyLNZZOFJADTYFAR-UHFFFAOYSA-N
XLogP3.29
TPSA83.98 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 803312
4-methyl-3-(pyridine-2-carbonylamino)benzoic acid
CID 16771811
N-(4-acetylphenyl)pyrazine-2-carboxamide
CID 803592
N-(2,4,5-trimethylphenyl)pyrazine-2-carboxamide
CID 110792925
N-(3-bromo-4-methylphenyl)pyrazine-2-carboxamide
CID 110699072
4-methyl-3-(2-methylpropanoylamino)-N-phenylbenzamide
CID 86977710
N-(3-benzamido-4-methylphenyl)pyridine-3-carboxamide
CID 6486649
2,6-dimethoxy-N-[2-methyl-5-(phenylcarbamoyl)phenyl]benzamide
CID 154838760
N-(4-hydroxy-2,5-dimethylphenyl)pyrazine-2-carboxamide
CID 136762067
N-(2,3-dimethylphenyl)pyrazine-2-carboxamide
CID 694797
6-methoxy-N-[2-methyl-5-(phenylcarbamoyl)phenyl]quinoline-2-carboxamide
CID 78887491
N-[5-(1H-benzimidazol-2-yl)-2-methylphenyl]pyrazine-2-carboxamide
CID 1448569

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide?
The IUPAC name of N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide (CID 87001470) is N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide.
What is the SMILES notation for N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide?
The canonical SMILES for N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide is Cc1ccc(C(=O)Nc2ccccc2)cc1NC(=O)c1cnccn1.
What is the InChIKey of N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide?
The InChIKey is LNZZOFJADTYFAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O2/c1-13-7-8-14(18(24)22-15-5-3-2-4-6-15)11-16(13)23-19(25)17-12-20-9-10-21-17/h2-12H,1H3,(H,22,24)(H,23,25).
What are the key properties of N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide?
N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide has a molecular weight of 332.36 g/mol, XLogP of 3.29, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-(phenylcarbamoyl)phenyl]pyrazine-2-carboxamide is sourced from PubChem (CID 87001470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).