4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one

C7H12N4O — CID 67635088

IUPAC4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one
SMILESCc1cn(N(C)C)c(=O)nc1N
InChIInChI=1S/C7H12N4O/c1-5-4-11(10(2)3)7(12)9-6(5)8/h4H,1-3H3,(H2,8,9,12)
InChIKeyBGYRXUSMPYNSEN-UHFFFAOYSA-N
MW168.20 g/mol
LogP-0.67
Rot. Bonds1

About 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one

4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one (PubChem CID 67635088) has the molecular formula C7H12N4O and a molecular weight of 168.20 g/mol. Its IUPAC name is 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one.

Molecular Properties

Compound Name4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one
PubChem CID67635088
Molecular FormulaC7H12N4O
Molecular Weight168.20 g/mol
Exact Mass168.10
IUPAC Name4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one
SMILESCc1cn(N(C)C)c(=O)nc1N
InChIInChI=1S/C7H12N4O/c1-5-4-11(10(2)3)7(12)9-6(5)8/h4H,1-3H3,(H2,8,9,12)
InChIKeyBGYRXUSMPYNSEN-UHFFFAOYSA-N
XLogP-0.67
TPSA64.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.20
LogP ≤ 5-0.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one?
The IUPAC name of 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one (CID 67635088) is 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one.
What is the SMILES notation for 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one?
The canonical SMILES for 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one is Cc1cn(N(C)C)c(=O)nc1N.
What is the InChIKey of 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one?
The InChIKey is BGYRXUSMPYNSEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N4O/c1-5-4-11(10(2)3)7(12)9-6(5)8/h4H,1-3H3,(H2,8,9,12).
What are the key properties of 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one?
4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one has a molecular weight of 168.20 g/mol, XLogP of -0.67, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-1-(dimethylamino)-5-methylpyrimidin-2-one is sourced from PubChem (CID 67635088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).