3-(dimethylamino)-6-methyl-1H-pyrazin-2-one

C7H11N3O — CID 176992180

IUPAC3-(dimethylamino)-6-methyl-1H-pyrazin-2-one
SMILESCc1cnc(N(C)C)c(=O)[nH]1
InChIInChI=1S/C7H11N3O/c1-5-4-8-6(10(2)3)7(11)9-5/h4H,1-3H3,(H,9,11)
InChIKeyCWCXMYBPXUVOOA-UHFFFAOYSA-N
MW153.19 g/mol
LogP0.14
Rot. Bonds1

About 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one

3-(dimethylamino)-6-methyl-1H-pyrazin-2-one (PubChem CID 176992180) has the molecular formula C7H11N3O and a molecular weight of 153.19 g/mol. Its IUPAC name is 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one.

Molecular Properties

Compound Name3-(dimethylamino)-6-methyl-1H-pyrazin-2-one
PubChem CID176992180
Molecular FormulaC7H11N3O
Molecular Weight153.19 g/mol
Exact Mass153.09
IUPAC Name3-(dimethylamino)-6-methyl-1H-pyrazin-2-one
SMILESCc1cnc(N(C)C)c(=O)[nH]1
InChIInChI=1S/C7H11N3O/c1-5-4-8-6(10(2)3)7(11)9-5/h4H,1-3H3,(H,9,11)
InChIKeyCWCXMYBPXUVOOA-UHFFFAOYSA-N
XLogP0.14
TPSA48.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.19
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one?
The IUPAC name of 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one (CID 176992180) is 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one.
What is the SMILES notation for 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one?
The canonical SMILES for 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one is Cc1cnc(N(C)C)c(=O)[nH]1.
What is the InChIKey of 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one?
The InChIKey is CWCXMYBPXUVOOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-5-4-8-6(10(2)3)7(11)9-5/h4H,1-3H3,(H,9,11).
What are the key properties of 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one?
3-(dimethylamino)-6-methyl-1H-pyrazin-2-one has a molecular weight of 153.19 g/mol, XLogP of 0.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-6-methyl-1H-pyrazin-2-one is sourced from PubChem (CID 176992180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).