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

C8H10ClN3O — CID 115599315

IUPACN-(6-chloropyrazin-2-yl)butanamide
SMILESCCCC(=O)Nc1cncc(Cl)n1
InChIInChI=1S/C8H10ClN3O/c1-2-3-8(13)12-7-5-10-4-6(9)11-7/h4-5H,2-3H2,1H3,(H,11,12,13)
InChIKeyFMYXYIQBBPMCIB-UHFFFAOYSA-N
MW199.64 g/mol
LogP1.87
Rot. Bonds3

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

N-(6-chloropyrazin-2-yl)butanamide (PubChem CID 115599315) has the molecular formula C8H10ClN3O and a molecular weight of 199.64 g/mol. Its IUPAC name is N-(6-chloropyrazin-2-yl)butanamide.

Molecular Properties

Compound NameN-(6-chloropyrazin-2-yl)butanamide
PubChem CID115599315
Molecular FormulaC8H10ClN3O
Molecular Weight199.64 g/mol
Exact Mass199.05
IUPAC NameN-(6-chloropyrazin-2-yl)butanamide
SMILESCCCC(=O)Nc1cncc(Cl)n1
InChIInChI=1S/C8H10ClN3O/c1-2-3-8(13)12-7-5-10-4-6(9)11-7/h4-5H,2-3H2,1H3,(H,11,12,13)
InChIKeyFMYXYIQBBPMCIB-UHFFFAOYSA-N
XLogP1.87
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.64
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(6-chloropyrazin-2-yl)-3-phenylpropanamide
CID 115599331
N-(7-chloro-1,8-naphthyridin-2-yl)butanamide
CID 102404571
6-chloro-N-propylpyrazin-2-amine
CID 26370207
N-(6-chloropyrazin-2-yl)-4-methoxy-3-methylbutanamide
CID 104820050
N-(6-chloropyrazin-2-yl)-2-(tetrazol-1-yl)acetamide
CID 115599406
N-(6-chloropyrazin-2-yl)-3-(oxan-2-yl)propanamide
CID 104819846
N-(6-chloropyrazin-2-yl)-5-ethylthiophene-2-carboxamide
CID 104819986
6-chloro-N-methylpyrazin-2-amine
CID 26967011
1-N-(6-chloropyrazin-2-yl)-2-methylpropane-1,2-diamine
CID 116650911
N-(6-chloropyrazin-2-yl)-2-(oxolan-2-yl)acetamide
CID 104819962
N-(6-chloropyrazin-2-yl)-2-methyl-2-phenylpropanamide
CID 104820021
6-[(6-chloropyrazin-2-yl)amino]-4,4-dimethylhexanoic acid
CID 114335451

Frequently Asked Questions

What is the IUPAC name of N-(6-chloropyrazin-2-yl)butanamide?
The IUPAC name of N-(6-chloropyrazin-2-yl)butanamide (CID 115599315) is N-(6-chloropyrazin-2-yl)butanamide.
What is the SMILES notation for N-(6-chloropyrazin-2-yl)butanamide?
The canonical SMILES for N-(6-chloropyrazin-2-yl)butanamide is CCCC(=O)Nc1cncc(Cl)n1.
What is the InChIKey of N-(6-chloropyrazin-2-yl)butanamide?
The InChIKey is FMYXYIQBBPMCIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3O/c1-2-3-8(13)12-7-5-10-4-6(9)11-7/h4-5H,2-3H2,1H3,(H,11,12,13).
What are the key properties of N-(6-chloropyrazin-2-yl)butanamide?
N-(6-chloropyrazin-2-yl)butanamide has a molecular weight of 199.64 g/mol, XLogP of 1.87, 3 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)butanamide is sourced from PubChem (CID 115599315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).