4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one

C7H11N3O — CID 135689647

IUPAC4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one
SMILESCc1nc(N(C)C)cc(=O)[nH]1
InChIInChI=1S/C7H11N3O/c1-5-8-6(10(2)3)4-7(11)9-5/h4H,1-3H3,(H,8,9,11)
InChIKeyJCVFYJPZRHEZHB-UHFFFAOYSA-N
MW153.18 g/mol
LogP0.14
Rot. Bonds1

About 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one

4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one (PubChem CID 135689647) has the molecular formula C7H11N3O and a molecular weight of 153.18 g/mol. Its IUPAC name is 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one.

Molecular Properties

Compound Name4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one
PubChem CID135689647
Molecular FormulaC7H11N3O
Molecular Weight153.18 g/mol
Exact Mass153.09
IUPAC Name4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one
SMILESCc1nc(N(C)C)cc(=O)[nH]1
InChIInChI=1S/C7H11N3O/c1-5-8-6(10(2)3)4-7(11)9-5/h4H,1-3H3,(H,8,9,11)
InChIKeyJCVFYJPZRHEZHB-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 ≤ 500153.18
LogP ≤ 50.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one?
The IUPAC name of 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one (CID 135689647) is 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one.
What is the SMILES notation for 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one?
The canonical SMILES for 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one is Cc1nc(N(C)C)cc(=O)[nH]1.
What is the InChIKey of 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one?
The InChIKey is JCVFYJPZRHEZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O/c1-5-8-6(10(2)3)4-7(11)9-5/h4H,1-3H3,(H,8,9,11).
What are the key properties of 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one?
4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one has a molecular weight of 153.18 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 4-(dimethylamino)-2-methyl-1H-pyrimidin-6-one is sourced from PubChem (CID 135689647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).