5-cyano-6-(diethylamino)pyrazine-2-carboxamide

C10H13N5O — CID 53318731

IUPAC5-cyano-6-(diethylamino)pyrazine-2-carboxamide
SMILESCCN(CC)c1nc(C(N)=O)cnc1C#N
InChIInChI=1S/C10H13N5O/c1-3-15(4-2)10-7(5-11)13-6-8(14-10)9(12)16/h6H,3-4H2,1-2H3,(H2,12,16)
InChIKeyDGUYUDHHFZRUAE-UHFFFAOYSA-N
MW219.25 g/mol
LogP0.29
Rot. Bonds4

About 5-cyano-6-(diethylamino)pyrazine-2-carboxamide

5-cyano-6-(diethylamino)pyrazine-2-carboxamide (PubChem CID 53318731) has the molecular formula C10H13N5O and a molecular weight of 219.25 g/mol. Its IUPAC name is 5-cyano-6-(diethylamino)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-cyano-6-(diethylamino)pyrazine-2-carboxamide
PubChem CID53318731
Molecular FormulaC10H13N5O
Molecular Weight219.25 g/mol
Exact Mass219.11
IUPAC Name5-cyano-6-(diethylamino)pyrazine-2-carboxamide
SMILESCCN(CC)c1nc(C(N)=O)cnc1C#N
InChIInChI=1S/C10H13N5O/c1-3-15(4-2)10-7(5-11)13-6-8(14-10)9(12)16/h6H,3-4H2,1-2H3,(H2,12,16)
InChIKeyDGUYUDHHFZRUAE-UHFFFAOYSA-N
XLogP0.29
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 ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-cyano-6-(diethylamino)pyrazine-2-carboxamide?
The IUPAC name of 5-cyano-6-(diethylamino)pyrazine-2-carboxamide (CID 53318731) is 5-cyano-6-(diethylamino)pyrazine-2-carboxamide.
What is the SMILES notation for 5-cyano-6-(diethylamino)pyrazine-2-carboxamide?
The canonical SMILES for 5-cyano-6-(diethylamino)pyrazine-2-carboxamide is CCN(CC)c1nc(C(N)=O)cnc1C#N.
What is the InChIKey of 5-cyano-6-(diethylamino)pyrazine-2-carboxamide?
The InChIKey is DGUYUDHHFZRUAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N5O/c1-3-15(4-2)10-7(5-11)13-6-8(14-10)9(12)16/h6H,3-4H2,1-2H3,(H2,12,16).
What are the key properties of 5-cyano-6-(diethylamino)pyrazine-2-carboxamide?
5-cyano-6-(diethylamino)pyrazine-2-carboxamide has a molecular weight of 219.25 g/mol, XLogP of 0.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyano-6-(diethylamino)pyrazine-2-carboxamide is sourced from PubChem (CID 53318731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).