N-(pyrazin-2-ylmethyl)propanamide

C8H11N3O — CID 66579184

IUPACN-(pyrazin-2-ylmethyl)propanamide
SMILESCCC(=O)NCc1cnccn1
InChIInChI=1S/C8H11N3O/c1-2-8(12)11-6-7-5-9-3-4-10-7/h3-5H,2,6H2,1H3,(H,11,12)
InChIKeyHCHUGNPPQSCEKM-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.50
Rot. Bonds3

About N-(pyrazin-2-ylmethyl)propanamide

N-(pyrazin-2-ylmethyl)propanamide (PubChem CID 66579184) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is N-(pyrazin-2-ylmethyl)propanamide.

Molecular Properties

Compound NameN-(pyrazin-2-ylmethyl)propanamide
PubChem CID66579184
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC NameN-(pyrazin-2-ylmethyl)propanamide
SMILESCCC(=O)NCc1cnccn1
InChIInChI=1S/C8H11N3O/c1-2-8(12)11-6-7-5-9-3-4-10-7/h3-5H,2,6H2,1H3,(H,11,12)
InChIKeyHCHUGNPPQSCEKM-UHFFFAOYSA-N
XLogP0.50
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(pyrazin-2-ylmethyl)propanamide?
The IUPAC name of N-(pyrazin-2-ylmethyl)propanamide (CID 66579184) is N-(pyrazin-2-ylmethyl)propanamide.
What is the SMILES notation for N-(pyrazin-2-ylmethyl)propanamide?
The canonical SMILES for N-(pyrazin-2-ylmethyl)propanamide is CCC(=O)NCc1cnccn1.
What is the InChIKey of N-(pyrazin-2-ylmethyl)propanamide?
The InChIKey is HCHUGNPPQSCEKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c1-2-8(12)11-6-7-5-9-3-4-10-7/h3-5H,2,6H2,1H3,(H,11,12).
What are the key properties of N-(pyrazin-2-ylmethyl)propanamide?
N-(pyrazin-2-ylmethyl)propanamide has a molecular weight of 165.20 g/mol, XLogP of 0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyrazin-2-ylmethyl)propanamide is sourced from PubChem (CID 66579184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).