N-ethyl-1,2-dihydropyrazine-5-carboxamide

C7H11N3O — CID 122522531

IUPACN-ethyl-1,2-dihydropyrazine-5-carboxamide
SMILESCCNC(=O)C1=CNCC=N1
InChIInChI=1S/C7H11N3O/c1-2-9-7(11)6-5-8-3-4-10-6/h4-5,8H,2-3H2,1H3,(H,9,11)
InChIKeyJQFKCYZCLDDUOI-UHFFFAOYSA-N
MW153.19 g/mol
LogP-0.36
Rot. Bonds2

About N-ethyl-1,2-dihydropyrazine-5-carboxamide

N-ethyl-1,2-dihydropyrazine-5-carboxamide (PubChem CID 122522531) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is N-ethyl-1,2-dihydropyrazine-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-1,2-dihydropyrazine-5-carboxamide
PubChem CID122522531
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC NameN-ethyl-1,2-dihydropyrazine-5-carboxamide
SMILESCCNC(=O)C1=CNCC=N1
InChIInChI=1S/C7H11N3O/c1-2-9-7(11)6-5-8-3-4-10-6/h4-5,8H,2-3H2,1H3,(H,9,11)
InChIKeyJQFKCYZCLDDUOI-UHFFFAOYSA-N
XLogP-0.36
TPSA53.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 5-0.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-1,2-dihydropyrazine-5-carboxamide?
The IUPAC name of N-ethyl-1,2-dihydropyrazine-5-carboxamide (CID 122522531) is N-ethyl-1,2-dihydropyrazine-5-carboxamide.
What is the SMILES notation for N-ethyl-1,2-dihydropyrazine-5-carboxamide?
The canonical SMILES for N-ethyl-1,2-dihydropyrazine-5-carboxamide is CCNC(=O)C1=CNCC=N1.
What is the InChIKey of N-ethyl-1,2-dihydropyrazine-5-carboxamide?
The InChIKey is JQFKCYZCLDDUOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-2-9-7(11)6-5-8-3-4-10-6/h4-5,8H,2-3H2,1H3,(H,9,11).
What are the key properties of N-ethyl-1,2-dihydropyrazine-5-carboxamide?
N-ethyl-1,2-dihydropyrazine-5-carboxamide has a molecular weight of 153.19 g/mol, XLogP of -0.36, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1,2-dihydropyrazine-5-carboxamide is sourced from PubChem (CID 122522531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).