N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide

C9H16N6O — CID 910847

IUPACN,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide
SMILESCNc1nc(C)nc(N(C)N(C)C(C)=O)n1
InChIInChI=1S/C9H16N6O/c1-6-11-8(10-3)13-9(12-6)15(5)14(4)7(2)16/h1-5H3,(H,10,11,12,13)
InChIKeyLFFQVSUYTBNFDK-UHFFFAOYSA-N
MW224.27 g/mol
LogP0.05
Rot. Bonds3

About N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide

N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide (PubChem CID 910847) has the molecular formula C9H16N6O and a molecular weight of 224.27 g/mol. Its IUPAC name is N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide.

Molecular Properties

Compound NameN,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide
PubChem CID910847
Molecular FormulaC9H16N6O
Molecular Weight224.27 g/mol
Exact Mass224.14
IUPAC NameN,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide
SMILESCNc1nc(C)nc(N(C)N(C)C(C)=O)n1
InChIInChI=1S/C9H16N6O/c1-6-11-8(10-3)13-9(12-6)15(5)14(4)7(2)16/h1-5H3,(H,10,11,12,13)
InChIKeyLFFQVSUYTBNFDK-UHFFFAOYSA-N
XLogP0.05
TPSA74.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.27
LogP ≤ 50.05
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 N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide?
The IUPAC name of N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide (CID 910847) is N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide.
What is the SMILES notation for N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide?
The canonical SMILES for N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide is CNc1nc(C)nc(N(C)N(C)C(C)=O)n1.
What is the InChIKey of N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide?
The InChIKey is LFFQVSUYTBNFDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6O/c1-6-11-8(10-3)13-9(12-6)15(5)14(4)7(2)16/h1-5H3,(H,10,11,12,13).
What are the key properties of N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide?
N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide has a molecular weight of 224.27 g/mol, XLogP of 0.05, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-dimethyl-N'-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]acetohydrazide is sourced from PubChem (CID 910847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).