1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide

C10H12N4O2 — CID 168697041

IUPAC1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCc1cncc(N2CC(C(N)=O)CC2=O)n1
InChIInChI=1S/C10H12N4O2/c1-6-3-12-4-8(13-6)14-5-7(10(11)16)2-9(14)15/h3-4,7H,2,5H2,1H3,(H2,11,16)
InChIKeyNTIUKBIITLIIRV-UHFFFAOYSA-N
MW220.23 g/mol
LogP-0.38
Rot. Bonds2

About 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide

1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide (PubChem CID 168697041) has the molecular formula C10H12N4O2 and a molecular weight of 220.23 g/mol. Its IUPAC name is 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide.

Molecular Properties

Compound Name1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide
PubChem CID168697041
Molecular FormulaC10H12N4O2
Molecular Weight220.23 g/mol
Exact Mass220.10
IUPAC Name1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide
SMILESCc1cncc(N2CC(C(N)=O)CC2=O)n1
InChIInChI=1S/C10H12N4O2/c1-6-3-12-4-8(13-6)14-5-7(10(11)16)2-9(14)15/h3-4,7H,2,5H2,1H3,(H2,11,16)
InChIKeyNTIUKBIITLIIRV-UHFFFAOYSA-N
XLogP-0.38
TPSA89.18 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.23
LogP ≤ 5-0.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide?
The IUPAC name of 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide (CID 168697041) is 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide.
What is the SMILES notation for 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide?
The canonical SMILES for 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide is Cc1cncc(N2CC(C(N)=O)CC2=O)n1.
What is the InChIKey of 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide?
The InChIKey is NTIUKBIITLIIRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12N4O2/c1-6-3-12-4-8(13-6)14-5-7(10(11)16)2-9(14)15/h3-4,7H,2,5H2,1H3,(H2,11,16).
What are the key properties of 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide?
1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide has a molecular weight of 220.23 g/mol, XLogP of -0.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-methylpyrazin-2-yl)-5-oxopyrrolidine-3-carboxamide is sourced from PubChem (CID 168697041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).