N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide

C13H10N4O — CID 113242357

IUPACN-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide
SMILESCN(C(=O)c1cnccn1)c1ccc(C#N)cc1
InChIInChI=1S/C13H10N4O/c1-17(11-4-2-10(8-14)3-5-11)13(18)12-9-15-6-7-16-12/h2-7,9H,1H3
InChIKeyRQKLGSOWZGFVMK-UHFFFAOYSA-N
MW238.25 g/mol
LogP1.62
Rot. Bonds2

About N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide

N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide (PubChem CID 113242357) has the molecular formula C13H10N4O and a molecular weight of 238.25 g/mol. Its IUPAC name is N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide
PubChem CID113242357
Molecular FormulaC13H10N4O
Molecular Weight238.25 g/mol
Exact Mass238.09
IUPAC NameN-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide
SMILESCN(C(=O)c1cnccn1)c1ccc(C#N)cc1
InChIInChI=1S/C13H10N4O/c1-17(11-4-2-10(8-14)3-5-11)13(18)12-9-15-6-7-16-12/h2-7,9H,1H3
InChIKeyRQKLGSOWZGFVMK-UHFFFAOYSA-N
XLogP1.62
TPSA69.88 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.25
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-cyanophenyl)-N-methylpyridazine-4-carboxamide
CID 104670312
N-(1,3-benzodioxol-5-yl)-N-methylpyrazine-2-carboxamide
CID 110752252
6-chloro-N-(4-cyanophenyl)-N-methylpyridine-2-carboxamide
CID 62981263
N-(4-cyanophenyl)-N-methyl-1,3-thiazole-5-carboxamide
CID 113290784
6-bromo-N-(4-cyanophenyl)-N-methylpyridine-3-carboxamide
CID 66463352
N-[(4-cyanophenyl)methyl]pyrazine-2-carboxamide
CID 110471356
4-cyano-N-(3,4-dimethylphenyl)-N-methylpyridine-2-carboxamide
CID 115116809
2,5-dichloro-N-(4-cyanophenyl)-N-methylpyridine-4-carboxamide
CID 114918456
N-(4-cyanophenyl)-N-methyl-2-(methylamino)pyridine-4-carboxamide
CID 62970236
3,5-dichloro-N-(4-cyanophenyl)-N-methylbenzamide
CID 62981026
N-(4-cyanophenyl)-N,5-dimethylthiophene-2-carboxamide
CID 55141574
N-(4-cyanophenyl)-N,2-dimethylbenzamide
CID 62982757

Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide (CID 113242357) is N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide is CN(C(=O)c1cnccn1)c1ccc(C#N)cc1.
What is the InChIKey of N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide?
The InChIKey is RQKLGSOWZGFVMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10N4O/c1-17(11-4-2-10(8-14)3-5-11)13(18)12-9-15-6-7-16-12/h2-7,9H,1H3.
What are the key properties of N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide?
N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide has a molecular weight of 238.25 g/mol, XLogP of 1.62, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-N-methylpyrazine-2-carboxamide is sourced from PubChem (CID 113242357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).