N-(5-methylpyrazin-2-yl)butanamide

C9H13N3O — CID 67185523

IUPACN-(5-methylpyrazin-2-yl)butanamide
SMILESCCCC(=O)Nc1cnc(C)cn1
InChIInChI=1S/C9H13N3O/c1-3-4-9(13)12-8-6-10-7(2)5-11-8/h5-6H,3-4H2,1-2H3,(H,11,12,13)
InChIKeyVLOWTVGGEXURGR-UHFFFAOYSA-N
MW179.22 g/mol
LogP1.52
Rot. Bonds3

About N-(5-methylpyrazin-2-yl)butanamide

N-(5-methylpyrazin-2-yl)butanamide (PubChem CID 67185523) has the molecular formula C9H13N3O and a molecular weight of 179.22 g/mol. Its IUPAC name is N-(5-methylpyrazin-2-yl)butanamide.

Molecular Properties

Compound NameN-(5-methylpyrazin-2-yl)butanamide
PubChem CID67185523
Molecular FormulaC9H13N3O
Molecular Weight179.22 g/mol
Exact Mass179.11
IUPAC NameN-(5-methylpyrazin-2-yl)butanamide
SMILESCCCC(=O)Nc1cnc(C)cn1
InChIInChI=1S/C9H13N3O/c1-3-4-9(13)12-8-6-10-7(2)5-11-8/h5-6H,3-4H2,1-2H3,(H,11,12,13)
InChIKeyVLOWTVGGEXURGR-UHFFFAOYSA-N
XLogP1.52
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.22
LogP ≤ 51.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-methyl-1H-pteridin-2-one
CID 595633
N-(6-methylpyrazin-2-yl)acetamide
CID 23273464
pteridin-2(1H)-one, 7-methyl-
CID 145826284
4-[(3,5-Dimethylpyrazin-2-yl)amino]-4-oxobutanoic acid
CID 2800619
6-methyl-N-propan-2-ylpyrazin-2-amine
CID 89879689
(3S)-3-[(3,6-dimethylpyrazin-2-yl)amino]azepan-2-one
CID 40506874
1-[3-[(3,6-Dimethylpyrazin-2-yl)amino]propyl]pyrrolidin-2-one
CID 132355363
2,2-Difluoro-N-(3,6-dimethylpyrazin-2-yl)acetamide
CID 57518299
N-[5-(trifluoromethyl)pyrazin-2-yl]acetamide
CID 70840605
N-[5-(trifluoromethyl)pyrazin-2-yl]propanamide
CID 121359350
2-methyl-N-[5-(trifluoromethyl)pyrazin-2-yl]propanamide
CID 132218260
ethane;2-methyl-N-[5-(trifluoromethyl)pyrazin-2-yl]propanamide
CID 145083469

Frequently Asked Questions

What is the IUPAC name of N-(5-methylpyrazin-2-yl)butanamide?
The IUPAC name of N-(5-methylpyrazin-2-yl)butanamide (CID 67185523) is N-(5-methylpyrazin-2-yl)butanamide.
What is the SMILES notation for N-(5-methylpyrazin-2-yl)butanamide?
The canonical SMILES for N-(5-methylpyrazin-2-yl)butanamide is CCCC(=O)Nc1cnc(C)cn1.
What is the InChIKey of N-(5-methylpyrazin-2-yl)butanamide?
The InChIKey is VLOWTVGGEXURGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13N3O/c1-3-4-9(13)12-8-6-10-7(2)5-11-8/h5-6H,3-4H2,1-2H3,(H,11,12,13).
What are the key properties of N-(5-methylpyrazin-2-yl)butanamide?
N-(5-methylpyrazin-2-yl)butanamide has a molecular weight of 179.22 g/mol, XLogP of 1.52, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-methylpyrazin-2-yl)butanamide is sourced from PubChem (CID 67185523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).