2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium

C5H6N5O+ — CID 136760117

IUPAC2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium
SMILESCc1nc(N)[nH]c(=O)c1[N+]#N
InChIInChI=1S/C5H5N5O/c1-2-3(10-7)4(11)9-5(6)8-2/h1H3,(H2-,6,8,9,11)/p+1
InChIKeyCAZPGNLXIFXYBX-UHFFFAOYSA-O
MW152.14 g/mol
LogP0.15
Rot. Bonds

About 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium

2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium (PubChem CID 136760117) has the molecular formula C5H6N5O+ and a molecular weight of 152.14 g/mol. Its IUPAC name is 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium.

Molecular Properties

Compound Name2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium
PubChem CID136760117
Molecular FormulaC5H6N5O+
Molecular Weight152.14 g/mol
Exact Mass152.06
IUPAC Name2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium
SMILESCc1nc(N)[nH]c(=O)c1[N+]#N
InChIInChI=1S/C5H5N5O/c1-2-3(10-7)4(11)9-5(6)8-2/h1H3,(H2-,6,8,9,11)/p+1
InChIKeyCAZPGNLXIFXYBX-UHFFFAOYSA-O
XLogP0.15
TPSA99.92 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.14
LogP ≤ 50.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Azo_group', 'substructure': 'N/A'}

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Related Compounds

2,5,6-Triamino-4(1H)-pyrimidinone
CID 135406869
2-Amino-5-fluoro-6-methylpyrimidin-4(1h)-one
CID 135455309
2,5-Diamino-6-methylpyrimidin-4(1h)-one
CID 135491050
5-amino-2-fluoro-4-methyl-1H-pyrimidin-6-one
CID 170192665
N-(2-amino-4-methyl-6-oxo-1H-pyrimidin-5-yl)acetamide
CID 135491051
5-Amino-6-methyl-2-(methylamino)pyrimidin-4(1H)-one
CID 136271532
5-amino-4-methyl-2-nitro-1H-pyrimidin-6-one
CID 136440872
2,5-diamino-4-methanimidoyl-1H-pyrimidin-6-one
CID 136473812
2-amino-5-(ethylideneamino)-4-methyl-1H-pyrimidin-6-one
CID 136482916
2-Amino-6-methyl-5-nitroso-4(3H)-pyrimidinone
CID 136484646
2,4-diamino-5-(methylideneamino)-1H-pyrimidin-6-one
CID 136600094
2-amino-4-methyl-5-(methylideneamino)-1H-pyrimidin-6-one
CID 136610584

Frequently Asked Questions

What is the IUPAC name of 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium?
The IUPAC name of 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium (CID 136760117) is 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium.
What is the SMILES notation for 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium?
The canonical SMILES for 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium is Cc1nc(N)[nH]c(=O)c1[N+]#N.
What is the InChIKey of 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium?
The InChIKey is CAZPGNLXIFXYBX-UHFFFAOYSA-O. The full InChI is InChI=1S/C5H5N5O/c1-2-3(10-7)4(11)9-5(6)8-2/h1H3,(H2-,6,8,9,11)/p+1.
What are the key properties of 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium?
2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium has a molecular weight of 152.14 g/mol, XLogP of 0.15, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-4-methyl-6-oxo-1H-pyrimidine-5-diazonium is sourced from PubChem (CID 136760117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).