5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione

C9H16N4O2 — CID 83004176

IUPAC5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione
SMILESCN(C)NCc1cn(C)c(=O)n(C)c1=O
InChIInChI=1S/C9H16N4O2/c1-11(2)10-5-7-6-12(3)9(15)13(4)8(7)14/h6,10H,5H2,1-4H3
InChIKeySAFFQOKGDWMKIH-UHFFFAOYSA-N
MW212.25 g/mol
LogP-1.35
Rot. Bonds3

About 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione

5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione (PubChem CID 83004176) has the molecular formula C9H16N4O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione.

Molecular Properties

Compound Name5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione
PubChem CID83004176
Molecular FormulaC9H16N4O2
Molecular Weight212.25 g/mol
Exact Mass212.13
IUPAC Name5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione
SMILESCN(C)NCc1cn(C)c(=O)n(C)c1=O
InChIInChI=1S/C9H16N4O2/c1-11(2)10-5-7-6-12(3)9(15)13(4)8(7)14/h6,10H,5H2,1-4H3
InChIKeySAFFQOKGDWMKIH-UHFFFAOYSA-N
XLogP-1.35
TPSA59.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 5-1.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
The IUPAC name of 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione (CID 83004176) is 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione.
What is the SMILES notation for 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
The canonical SMILES for 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione is CN(C)NCc1cn(C)c(=O)n(C)c1=O.
What is the InChIKey of 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
The InChIKey is SAFFQOKGDWMKIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O2/c1-11(2)10-5-7-6-12(3)9(15)13(4)8(7)14/h6,10H,5H2,1-4H3.
What are the key properties of 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione?
5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione has a molecular weight of 212.25 g/mol, XLogP of -1.35, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2,2-dimethylhydrazinyl)methyl]-1,3-dimethylpyrimidine-2,4-dione is sourced from PubChem (CID 83004176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).