6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one

C6H11N3O — CID 141299456

IUPAC6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one
SMILESCC1N=C(N)CN(C)C1=O
InChIInChI=1S/C6H11N3O/c1-4-6(10)9(2)3-5(7)8-4/h4H,3H2,1-2H3,(H2,7,8)
InChIKeyVFDVQXJOLRSOFN-UHFFFAOYSA-N
MW141.17 g/mol
LogP-0.80
Rot. Bonds

About 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one

6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one (PubChem CID 141299456) has the molecular formula C6H11N3O and a molecular weight of 141.17 g/mol. Its IUPAC name is 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one.

Molecular Properties

Compound Name6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one
PubChem CID141299456
Molecular FormulaC6H11N3O
Molecular Weight141.17 g/mol
Exact Mass141.09
IUPAC Name6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one
SMILESCC1N=C(N)CN(C)C1=O
InChIInChI=1S/C6H11N3O/c1-4-6(10)9(2)3-5(7)8-4/h4H,3H2,1-2H3,(H2,7,8)
InChIKeyVFDVQXJOLRSOFN-UHFFFAOYSA-N
XLogP-0.80
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 5-0.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one?
The IUPAC name of 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one (CID 141299456) is 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one.
What is the SMILES notation for 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one?
The canonical SMILES for 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one is CC1N=C(N)CN(C)C1=O.
What is the InChIKey of 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one?
The InChIKey is VFDVQXJOLRSOFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N3O/c1-4-6(10)9(2)3-5(7)8-4/h4H,3H2,1-2H3,(H2,7,8).
What are the key properties of 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one?
6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one has a molecular weight of 141.17 g/mol, XLogP of -0.80, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2,4-dimethyl-2,5-dihydropyrazin-3-one is sourced from PubChem (CID 141299456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).