1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one

C10H15N3O — CID 130571112

IUPAC1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one
SMILESCc1nccn(CC(N)C2CC2)c1=O
InChIInChI=1S/C10H15N3O/c1-7-10(14)13(5-4-12-7)6-9(11)8-2-3-8/h4-5,8-9H,2-3,6,11H2,1H3
InChIKeyBUIRFEMZRPCSHT-UHFFFAOYSA-N
MW193.25 g/mol
LogP0.29
Rot. Bonds3

About 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one

1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one (PubChem CID 130571112) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one.

Molecular Properties

Compound Name1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one
PubChem CID130571112
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Name1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one
SMILESCc1nccn(CC(N)C2CC2)c1=O
InChIInChI=1S/C10H15N3O/c1-7-10(14)13(5-4-12-7)6-9(11)8-2-3-8/h4-5,8-9H,2-3,6,11H2,1H3
InChIKeyBUIRFEMZRPCSHT-UHFFFAOYSA-N
XLogP0.29
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-methyl-1-[(3R)-piperidin-3-yl]pyrazin-2-one
CID 166162659
1-(2-Amino-2-cyclopropylethyl)-4-methylpyrazine-2,3-dione
CID 63912012
1-(2-Amino-3-methylbutyl)pyrazin-2-one
CID 130538505
1-[(2S)-2-aminopropyl]-3-methylpyrazin-2-one
CID 130571109
3-methyl-1-[[(2S)-pyrrolidin-2-yl]methyl]pyrazin-2-one
CID 130571131
3-methyl-1-[[(2R)-pyrrolidin-2-yl]methyl]pyrazin-2-one
CID 130571133
1-(2-Cyclopropylethyl)-3-methylpyrazin-2-one
CID 130571194

Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one?
The IUPAC name of 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one (CID 130571112) is 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one.
What is the SMILES notation for 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one?
The canonical SMILES for 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one is Cc1nccn(CC(N)C2CC2)c1=O.
What is the InChIKey of 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one?
The InChIKey is BUIRFEMZRPCSHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3O/c1-7-10(14)13(5-4-12-7)6-9(11)8-2-3-8/h4-5,8-9H,2-3,6,11H2,1H3.
What are the key properties of 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one?
1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one has a molecular weight of 193.25 g/mol, XLogP of 0.29, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-2-cyclopropylethyl)-3-methylpyrazin-2-one is sourced from PubChem (CID 130571112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).