5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide

C10H13N5O — CID 107375045

IUPAC5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide
SMILESCCN(CCC#N)C(=O)c1cnc(N)cn1
InChIInChI=1S/C10H13N5O/c1-2-15(5-3-4-11)10(16)8-6-14-9(12)7-13-8/h6-7H,2-3,5H2,1H3,(H2,12,14)
InChIKeyXXEUVJXLNUFKAR-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.43
Rot. Bonds4

About 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide

5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide (PubChem CID 107375045) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide
PubChem CID107375045
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide
SMILESCCN(CCC#N)C(=O)c1cnc(N)cn1
InChIInChI=1S/C10H13N5O/c1-2-15(5-3-4-11)10(16)8-6-14-9(12)7-13-8/h6-7H,2-3,5H2,1H3,(H2,12,14)
InChIKeyXXEUVJXLNUFKAR-UHFFFAOYSA-N
XLogP0.43
TPSA95.90 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.25
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N,N-bis(2-cyanoethyl)pyrazine-2-carboxamide
CID 107371836
2-amino-N-(2-cyanoethyl)-N-ethylpyridine-3-carboxamide
CID 62161601
2-amino-N-(2-cyanoethyl)-N-ethyl-5-nitropyridine-3-carboxamide
CID 104589851
N-(2-cyanoethyl)-N-ethyl-6-hydrazinylpyridazine-3-carboxamide
CID 62248946
6-amino-N-(2-cyanoethyl)-N-(2-methylpropyl)pyridazine-3-carboxamide
CID 62160013
N-(2-cyanoethyl)-5-methyl-N-propan-2-ylpyrazine-2-carboxamide
CID 103636019
5-amino-N-(2-cyanoethyl)-N-ethyl-2,4-dimethylbenzamide
CID 102705262
N-ethyl-5-hydrazinyl-N-propylpyrazine-2-carboxamide
CID 107378064
4-amino-N-(2-cyanoethyl)-N-ethyl-1,3-dimethylpyrazole-5-carboxamide
CID 66125538
3-amino-2-bromo-N-(2-cyanoethyl)-N-ethylbenzamide
CID 113366975
N-(2-cyanoethyl)-N-ethyl-1-(methylamino)isoquinoline-3-carboxamide
CID 62174806
5-cyano-N-ethyl-N-propylpyridine-2-carboxamide
CID 63717846

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide?
The IUPAC name of 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide (CID 107375045) is 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide.
What is the SMILES notation for 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide?
The canonical SMILES for 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide is CCN(CCC#N)C(=O)c1cnc(N)cn1.
What is the InChIKey of 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide?
The InChIKey is XXEUVJXLNUFKAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-2-15(5-3-4-11)10(16)8-6-14-9(12)7-13-8/h6-7H,2-3,5H2,1H3,(H2,12,14).
What are the key properties of 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide?
5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide has a molecular weight of 219.25 g/mol, XLogP of 0.43, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(2-cyanoethyl)-N-ethylpyrazine-2-carboxamide is sourced from PubChem (CID 107375045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).