1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide

C9H6N6O — CID 64782154

IUPAC1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide
SMILESN#Cc1cnc(-n2cc(C(N)=O)cn2)cn1
InChIInChI=1S/C9H6N6O/c10-1-7-3-13-8(4-12-7)15-5-6(2-14-15)9(11)16/h2-5H,(H2,11,16)
InChIKeySAEJVYRWKVOSFQ-UHFFFAOYSA-N
MW214.19 g/mol
LogP-0.37
Rot. Bonds2

About 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide

1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide (PubChem CID 64782154) has the molecular formula C9H6N6O and a molecular weight of 214.19 g/mol. Its IUPAC name is 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide
PubChem CID64782154
Molecular FormulaC9H6N6O
Molecular Weight214.19 g/mol
Exact Mass214.06
IUPAC Name1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide
SMILESN#Cc1cnc(-n2cc(C(N)=O)cn2)cn1
InChIInChI=1S/C9H6N6O/c10-1-7-3-13-8(4-12-7)15-5-6(2-14-15)9(11)16/h2-5H,(H2,11,16)
InChIKeySAEJVYRWKVOSFQ-UHFFFAOYSA-N
XLogP-0.37
TPSA110.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.19
LogP ≤ 5-0.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide?
The IUPAC name of 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide (CID 64782154) is 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide.
What is the SMILES notation for 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide?
The canonical SMILES for 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide is N#Cc1cnc(-n2cc(C(N)=O)cn2)cn1.
What is the InChIKey of 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide?
The InChIKey is SAEJVYRWKVOSFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H6N6O/c10-1-7-3-13-8(4-12-7)15-5-6(2-14-15)9(11)16/h2-5H,(H2,11,16).
What are the key properties of 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide?
1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide has a molecular weight of 214.19 g/mol, XLogP of -0.37, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-cyanopyrazin-2-yl)pyrazole-4-carboxamide is sourced from PubChem (CID 64782154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).