N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide

C9H13N3O2 — CID 130571190

IUPACN-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide
SMILESCNC(=O)CCn1ccnc(C)c1=O
InChIInChI=1S/C9H13N3O2/c1-7-9(14)12(6-4-11-7)5-3-8(13)10-2/h4,6H,3,5H2,1-2H3,(H,10,13)
InChIKeyGUUVRHVWHCYOBF-UHFFFAOYSA-N
MW195.22 g/mol
LogP-0.31
Rot. Bonds3

About N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide

N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide (PubChem CID 130571190) has the molecular formula C9H13N3O2 and a molecular weight of 195.22 g/mol. Its IUPAC name is N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide.

Molecular Properties

Compound NameN-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide
PubChem CID130571190
Molecular FormulaC9H13N3O2
Molecular Weight195.22 g/mol
Exact Mass195.10
IUPAC NameN-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide
SMILESCNC(=O)CCn1ccnc(C)c1=O
InChIInChI=1S/C9H13N3O2/c1-7-9(14)12(6-4-11-7)5-3-8(13)10-2/h4,6H,3,5H2,1-2H3,(H,10,13)
InChIKeyGUUVRHVWHCYOBF-UHFFFAOYSA-N
XLogP-0.31
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 5-0.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide?
The IUPAC name of N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide (CID 130571190) is N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide.
What is the SMILES notation for N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide?
The canonical SMILES for N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide is CNC(=O)CCn1ccnc(C)c1=O.
What is the InChIKey of N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide?
The InChIKey is GUUVRHVWHCYOBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O2/c1-7-9(14)12(6-4-11-7)5-3-8(13)10-2/h4,6H,3,5H2,1-2H3,(H,10,13).
What are the key properties of N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide?
N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide has a molecular weight of 195.22 g/mol, XLogP of -0.31, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-3-(3-methyl-2-oxopyrazin-1-yl)propanamide is sourced from PubChem (CID 130571190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).