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

C5H9N5O — CID 54348830

IUPACN-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine
SMILESCNc1nc(C)nc(NO)n1
InChIInChI=1S/C5H9N5O/c1-3-7-4(6-2)9-5(8-3)10-11/h11H,1-2H3,(H2,6,7,8,9,10)
InChIKeyUEFUXWHGQBVULE-UHFFFAOYSA-N
MW155.16 g/mol
LogP0.02
Rot. Bonds2

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

N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine (PubChem CID 54348830) has the molecular formula C5H9N5O and a molecular weight of 155.16 g/mol. Its IUPAC name is N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine.

Molecular Properties

Compound NameN-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine
PubChem CID54348830
Molecular FormulaC5H9N5O
Molecular Weight155.16 g/mol
Exact Mass155.08
IUPAC NameN-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine
SMILESCNc1nc(C)nc(NO)n1
InChIInChI=1S/C5H9N5O/c1-3-7-4(6-2)9-5(8-3)10-11/h11H,1-2H3,(H2,6,7,8,9,10)
InChIKeyUEFUXWHGQBVULE-UHFFFAOYSA-N
XLogP0.02
TPSA82.96 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 50.02
H-Bond Donors ≤ 53
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-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine?
The IUPAC name of N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine (CID 54348830) is N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine.
What is the SMILES notation for N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine?
The canonical SMILES for N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine is CNc1nc(C)nc(NO)n1.
What is the InChIKey of N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine?
The InChIKey is UEFUXWHGQBVULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N5O/c1-3-7-4(6-2)9-5(8-3)10-11/h11H,1-2H3,(H2,6,7,8,9,10).
What are the key properties of N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine?
N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine has a molecular weight of 155.16 g/mol, XLogP of 0.02, 2 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-6-(methylamino)-1,3,5-triazin-2-yl]hydroxylamine is sourced from PubChem (CID 54348830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).