N-(6-chloropyrazin-2-yl)acetamide

C6H6ClN3O — CID 14787673

IUPACN-(6-chloropyrazin-2-yl)acetamide
SMILESCC(=O)Nc1cncc(Cl)n1
InChIInChI=1S/C6H6ClN3O/c1-4(11)9-6-3-8-2-5(7)10-6/h2-3H,1H3,(H,9,10,11)
InChIKeyULFJKYKKTRODFV-UHFFFAOYSA-N
MW171.59 g/mol
LogP1.09
Rot. Bonds1

About N-(6-chloropyrazin-2-yl)acetamide

N-(6-chloropyrazin-2-yl)acetamide (PubChem CID 14787673) has the molecular formula C6H6ClN3O and a molecular weight of 171.59 g/mol. Its IUPAC name is N-(6-chloropyrazin-2-yl)acetamide.

Molecular Properties

Compound NameN-(6-chloropyrazin-2-yl)acetamide
PubChem CID14787673
Molecular FormulaC6H6ClN3O
Molecular Weight171.59 g/mol
Exact Mass171.02
IUPAC NameN-(6-chloropyrazin-2-yl)acetamide
SMILESCC(=O)Nc1cncc(Cl)n1
InChIInChI=1S/C6H6ClN3O/c1-4(11)9-6-3-8-2-5(7)10-6/h2-3H,1H3,(H,9,10,11)
InChIKeyULFJKYKKTRODFV-UHFFFAOYSA-N
XLogP1.09
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.59
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(6-chloropyrazin-2-yl)acetamide?
The IUPAC name of N-(6-chloropyrazin-2-yl)acetamide (CID 14787673) is N-(6-chloropyrazin-2-yl)acetamide.
What is the SMILES notation for N-(6-chloropyrazin-2-yl)acetamide?
The canonical SMILES for N-(6-chloropyrazin-2-yl)acetamide is CC(=O)Nc1cncc(Cl)n1.
What is the InChIKey of N-(6-chloropyrazin-2-yl)acetamide?
The InChIKey is ULFJKYKKTRODFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClN3O/c1-4(11)9-6-3-8-2-5(7)10-6/h2-3H,1H3,(H,9,10,11).
What are the key properties of N-(6-chloropyrazin-2-yl)acetamide?
N-(6-chloropyrazin-2-yl)acetamide has a molecular weight of 171.59 g/mol, XLogP of 1.09, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-chloropyrazin-2-yl)acetamide is sourced from PubChem (CID 14787673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).