1,5-dimethyl-4-(methylamino)pyrimidin-2-one

C7H11N3O — CID 10351878

IUPAC1,5-dimethyl-4-(methylamino)pyrimidin-2-one
SMILESCNc1nc(=O)n(C)cc1C
InChIInChI=1S/C7H11N3O/c1-5-4-10(3)7(11)9-6(5)8-2/h4H,1-3H3,(H,8,9,11)
InChIKeyPZENZRNMLUTARH-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.13
Rot. Bonds1

About 1,5-dimethyl-4-(methylamino)pyrimidin-2-one

1,5-dimethyl-4-(methylamino)pyrimidin-2-one (PubChem CID 10351878) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 1,5-dimethyl-4-(methylamino)pyrimidin-2-one.

Molecular Properties

Compound Name1,5-dimethyl-4-(methylamino)pyrimidin-2-one
PubChem CID10351878
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name1,5-dimethyl-4-(methylamino)pyrimidin-2-one
SMILESCNc1nc(=O)n(C)cc1C
InChIInChI=1S/C7H11N3O/c1-5-4-10(3)7(11)9-6(5)8-2/h4H,1-3H3,(H,8,9,11)
InChIKeyPZENZRNMLUTARH-UHFFFAOYSA-N
XLogP0.13
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.18
LogP ≤ 50.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1,5-dimethyl-4-(methylamino)pyrimidin-2-one?
The IUPAC name of 1,5-dimethyl-4-(methylamino)pyrimidin-2-one (CID 10351878) is 1,5-dimethyl-4-(methylamino)pyrimidin-2-one.
What is the SMILES notation for 1,5-dimethyl-4-(methylamino)pyrimidin-2-one?
The canonical SMILES for 1,5-dimethyl-4-(methylamino)pyrimidin-2-one is CNc1nc(=O)n(C)cc1C.
What is the InChIKey of 1,5-dimethyl-4-(methylamino)pyrimidin-2-one?
The InChIKey is PZENZRNMLUTARH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-5-4-10(3)7(11)9-6(5)8-2/h4H,1-3H3,(H,8,9,11).
What are the key properties of 1,5-dimethyl-4-(methylamino)pyrimidin-2-one?
1,5-dimethyl-4-(methylamino)pyrimidin-2-one has a molecular weight of 153.18 g/mol, XLogP of 0.13, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5-dimethyl-4-(methylamino)pyrimidin-2-one is sourced from PubChem (CID 10351878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).