N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide

C20H17N5O — CID 109291580

IUPACN-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide
SMILESCCc1ccccc1Nc1cnc(C(=O)Nc2ccccc2C#N)cn1
InChIInChI=1S/C20H17N5O/c1-2-14-7-3-5-9-16(14)24-19-13-22-18(12-23-19)20(26)25-17-10-6-4-8-15(17)11-21/h3-10,12-13H,2H2,1H3,(H,23,24)(H,25,26)
InChIKeyKQLVPJCETLASAH-UHFFFAOYSA-N
MW343.39 g/mol
LogP3.91
Rot. Bonds5

About N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide

N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide (PubChem CID 109291580) has the molecular formula C20H17N5O and a molecular weight of 343.39 g/mol. Its IUPAC name is N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide
PubChem CID109291580
Molecular FormulaC20H17N5O
Molecular Weight343.39 g/mol
Exact Mass343.14
IUPAC NameN-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide
SMILESCCc1ccccc1Nc1cnc(C(=O)Nc2ccccc2C#N)cn1
InChIInChI=1S/C20H17N5O/c1-2-14-7-3-5-9-16(14)24-19-13-22-18(12-23-19)20(26)25-17-10-6-4-8-15(17)11-21/h3-10,12-13H,2H2,1H3,(H,23,24)(H,25,26)
InChIKeyKQLVPJCETLASAH-UHFFFAOYSA-N
XLogP3.91
TPSA90.70 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.39
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-(2-cyanoanilino)-N-(2-cyanophenyl)pyrazine-2-carboxamide
CID 109294656
5-(2-bromoanilino)-N-(2-cyanophenyl)pyrazine-2-carboxamide
CID 109294390
N-(2-cyanophenyl)-5-(propylamino)pyrazine-2-carboxamide
CID 109271145
N-(2-cyanophenyl)-6-(2-ethylanilino)pyridazine-3-carboxamide
CID 109127922
N-(2-cyanophenyl)-5-(2,5-dimethylanilino)pyrazine-2-carboxamide
CID 109290955
N-(4-acetamidophenyl)-5-(2-cyanoanilino)pyrazine-2-carboxamide
CID 109294144
5-(2-cyanoanilino)-N-(4-ethoxyphenyl)pyrazine-2-carboxamide
CID 109293739
N-(2-cyanophenyl)-4-(2-ethylanilino)pyridine-2-carboxamide
CID 109220187
5-(2,3-dimethylanilino)-N-(2-ethylphenyl)pyrazine-2-carboxamide
CID 109291406
5-(2-cyanoanilino)-N-(4-cyanophenyl)pyrazine-2-carboxamide
CID 109294665
methyl 4-[[5-(2-ethylanilino)pyrazine-2-carbonyl]amino]benzoate
CID 109291565
5-(2-ethylanilino)-N-quinolin-8-ylpyrazine-2-carboxamide
CID 109291574

Frequently Asked Questions

What is the IUPAC name of N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide?
The IUPAC name of N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide (CID 109291580) is N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide.
What is the SMILES notation for N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide?
The canonical SMILES for N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide is CCc1ccccc1Nc1cnc(C(=O)Nc2ccccc2C#N)cn1.
What is the InChIKey of N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide?
The InChIKey is KQLVPJCETLASAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N5O/c1-2-14-7-3-5-9-16(14)24-19-13-22-18(12-23-19)20(26)25-17-10-6-4-8-15(17)11-21/h3-10,12-13H,2H2,1H3,(H,23,24)(H,25,26).
What are the key properties of N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide?
N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide has a molecular weight of 343.39 g/mol, XLogP of 3.91, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyanophenyl)-5-(2-ethylanilino)pyrazine-2-carboxamide is sourced from PubChem (CID 109291580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).