6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride

C5H10ClN3O — CID 20847933

IUPAC6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride
SMILESCN1CCC(N)=NC1=O.Cl
InChIInChI=1S/C5H9N3O.ClH/c1-8-3-2-4(6)7-5(8)9;/h2-3H2,1H3,(H2,6,7,9);1H
InChIKeyNHMBCILBNZBUNQ-UHFFFAOYSA-N
MW163.61 g/mol
LogP0.22
Rot. Bonds

About 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride

6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride (PubChem CID 20847933) has the molecular formula C5H10ClN3O and a molecular weight of 163.61 g/mol. Its IUPAC name is 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride.

Molecular Properties

Compound Name6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride
PubChem CID20847933
Molecular FormulaC5H10ClN3O
Molecular Weight163.61 g/mol
Exact Mass163.05
IUPAC Name6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride
SMILESCN1CCC(N)=NC1=O.Cl
InChIInChI=1S/C5H9N3O.ClH/c1-8-3-2-4(6)7-5(8)9;/h2-3H2,1H3,(H2,6,7,9);1H
InChIKeyNHMBCILBNZBUNQ-UHFFFAOYSA-N
XLogP0.22
TPSA58.69 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.61
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride?
The IUPAC name of 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride (CID 20847933) is 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride.
What is the SMILES notation for 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride?
The canonical SMILES for 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride is CN1CCC(N)=NC1=O.Cl.
What is the InChIKey of 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride?
The InChIKey is NHMBCILBNZBUNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N3O.ClH/c1-8-3-2-4(6)7-5(8)9;/h2-3H2,1H3,(H2,6,7,9);1H.
What are the key properties of 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride?
6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride has a molecular weight of 163.61 g/mol, XLogP of 0.22, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-methyl-4,5-dihydropyrimidin-2-one;hydrochloride is sourced from PubChem (CID 20847933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).