3-methoxy-N-pyrazin-2-ylpropanamide

C8H11N3O2 — CID 127118096

IUPAC3-methoxy-N-pyrazin-2-ylpropanamide
SMILESCOCCC(=O)Nc1cnccn1
InChIInChI=1S/C8H11N3O2/c1-13-5-2-8(12)11-7-6-9-3-4-10-7/h3-4,6H,2,5H2,1H3,(H,10,11,12)
InChIKeyFJBUIGRQJRSFBQ-UHFFFAOYSA-N
MW181.20 g/mol
LogP0.45
Rot. Bonds4

About 3-methoxy-N-pyrazin-2-ylpropanamide

3-methoxy-N-pyrazin-2-ylpropanamide (PubChem CID 127118096) has the molecular formula C8H11N3O2 and a molecular weight of 181.20 g/mol. Its IUPAC name is 3-methoxy-N-pyrazin-2-ylpropanamide.

Molecular Properties

Compound Name3-methoxy-N-pyrazin-2-ylpropanamide
PubChem CID127118096
Molecular FormulaC8H11N3O2
Molecular Weight181.20 g/mol
Exact Mass181.09
IUPAC Name3-methoxy-N-pyrazin-2-ylpropanamide
SMILESCOCCC(=O)Nc1cnccn1
InChIInChI=1S/C8H11N3O2/c1-13-5-2-8(12)11-7-6-9-3-4-10-7/h3-4,6H,2,5H2,1H3,(H,10,11,12)
InChIKeyFJBUIGRQJRSFBQ-UHFFFAOYSA-N
XLogP0.45
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.20
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-pyrazin-2-ylpropanamide?
The IUPAC name of 3-methoxy-N-pyrazin-2-ylpropanamide (CID 127118096) is 3-methoxy-N-pyrazin-2-ylpropanamide.
What is the SMILES notation for 3-methoxy-N-pyrazin-2-ylpropanamide?
The canonical SMILES for 3-methoxy-N-pyrazin-2-ylpropanamide is COCCC(=O)Nc1cnccn1.
What is the InChIKey of 3-methoxy-N-pyrazin-2-ylpropanamide?
The InChIKey is FJBUIGRQJRSFBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2/c1-13-5-2-8(12)11-7-6-9-3-4-10-7/h3-4,6H,2,5H2,1H3,(H,10,11,12).
What are the key properties of 3-methoxy-N-pyrazin-2-ylpropanamide?
3-methoxy-N-pyrazin-2-ylpropanamide has a molecular weight of 181.20 g/mol, XLogP of 0.45, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-pyrazin-2-ylpropanamide is sourced from PubChem (CID 127118096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).