2-amino-1-pyrazin-2-ylpropan-1-one

C7H9N3O — CID 82594837

IUPAC2-amino-1-pyrazin-2-ylpropan-1-one
SMILESCC(N)C(=O)c1cnccn1
InChIInChI=1S/C7H9N3O/c1-5(8)7(11)6-4-9-2-3-10-6/h2-5H,8H2,1H3
InChIKeyBLBFYZVVRMUMGO-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.01
Rot. Bonds2

About 2-amino-1-pyrazin-2-ylpropan-1-one

2-amino-1-pyrazin-2-ylpropan-1-one (PubChem CID 82594837) has the molecular formula C7H9N3O and a molecular weight of 151.17 g/mol. Its IUPAC name is 2-amino-1-pyrazin-2-ylpropan-1-one.

Molecular Properties

Compound Name2-amino-1-pyrazin-2-ylpropan-1-one
PubChem CID82594837
Molecular FormulaC7H9N3O
Molecular Weight151.17 g/mol
Exact Mass151.07
IUPAC Name2-amino-1-pyrazin-2-ylpropan-1-one
SMILESCC(N)C(=O)c1cnccn1
InChIInChI=1S/C7H9N3O/c1-5(8)7(11)6-4-9-2-3-10-6/h2-5H,8H2,1H3
InChIKeyBLBFYZVVRMUMGO-UHFFFAOYSA-N
XLogP0.01
TPSA68.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methyl-1-pyrazin-2-ylpropan-1-one
CID 538058
2-amino-1-pyrazin-2-ylbutan-1-one
CID 116584056
2-amino-4-methylsulfonyl-1-pyrazin-2-ylbutan-1-one
CID 116552025
2-amino-1-pyrazin-2-ylpent-4-en-1-one
CID 116606989
N'-propan-2-ylpyrazine-2-carboximidamide
CID 63181346
propan-2-yl pyrazine-2-carboxylate
CID 3022328
5-amino-1-pyrazin-2-ylhexan-1-one
CID 116610178
N-[(2S)-1-amino-1-oxopropan-2-yl]pyrazine-2-carboxamide
CID 130166243
ethane;N-propan-2-ylpyrazine-2-carboxamide
CID 143147775
N-(2,4-dimethylpentan-3-yl)pyrazine-2-carboxamide
CID 20782723
4-methyl-1-pyrazin-2-ylpentan-1-one
CID 62620603
ethyl 2-(pyrazine-2-carbonyl)hexanoate
CID 21329208

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-pyrazin-2-ylpropan-1-one?
The IUPAC name of 2-amino-1-pyrazin-2-ylpropan-1-one (CID 82594837) is 2-amino-1-pyrazin-2-ylpropan-1-one.
What is the SMILES notation for 2-amino-1-pyrazin-2-ylpropan-1-one?
The canonical SMILES for 2-amino-1-pyrazin-2-ylpropan-1-one is CC(N)C(=O)c1cnccn1.
What is the InChIKey of 2-amino-1-pyrazin-2-ylpropan-1-one?
The InChIKey is BLBFYZVVRMUMGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3O/c1-5(8)7(11)6-4-9-2-3-10-6/h2-5H,8H2,1H3.
What are the key properties of 2-amino-1-pyrazin-2-ylpropan-1-one?
2-amino-1-pyrazin-2-ylpropan-1-one has a molecular weight of 151.17 g/mol, XLogP of 0.01, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-pyrazin-2-ylpropan-1-one is sourced from PubChem (CID 82594837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).