2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine

C13H19N7 — CID 80917534

IUPAC2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(NN)nc(N(C)Cc2ccccc2)n1
InChIInChI=1S/C13H19N7/c1-19(2)12-15-11(18-14)16-13(17-12)20(3)9-10-7-5-4-6-8-10/h4-8H,9,14H2,1-3H3,(H,15,16,17,18)
InChIKeyGUQJOCQMJNKQCZ-UHFFFAOYSA-N
MW273.34 g/mol
LogP0.86
Rot. Bonds5

About 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine

2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 80917534) has the molecular formula C13H19N7 and a molecular weight of 273.34 g/mol. Its IUPAC name is 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
PubChem CID80917534
Molecular FormulaC13H19N7
Molecular Weight273.34 g/mol
Exact Mass273.17
IUPAC Name2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
SMILESCN(C)c1nc(NN)nc(N(C)Cc2ccccc2)n1
InChIInChI=1S/C13H19N7/c1-19(2)12-15-11(18-14)16-13(17-12)20(3)9-10-7-5-4-6-8-10/h4-8H,9,14H2,1-3H3,(H,15,16,17,18)
InChIKeyGUQJOCQMJNKQCZ-UHFFFAOYSA-N
XLogP0.86
TPSA83.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 50.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

N-benzyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80917380
6-hydrazinyl-2-N,4-N,4-N-trimethyl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 80927617
2-N-ethyl-6-hydrazinyl-4-N,4-N-dimethyl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 80918358
N-benzyl-2-hydrazinyl-N,6-dimethylpyrimidin-4-amine
CID 80918150
N-benzyl-2-hydrazinyl-N-methylquinazolin-4-amine
CID 80909730
4-hydrazinyl-N,N-dimethyl-6-phenylsulfanyl-1,3,5-triazin-2-amine
CID 80925510
4-hydrazinyl-6-methoxy-N-methyl-N-(pyridin-3-ylmethyl)-1,3,5-triazin-2-amine
CID 80906839
2-N-[(3-chlorophenyl)methyl]-2-N,4-N,4-N,6-N-tetramethyl-1,3,5-triazine-2,4,6-triamine
CID 80777695
N-benzyl-N,4,6-trimethylpyrimidin-2-amine
CID 734467
2-N,4-N,4-N-trimethyl-2-N-[(4-methylphenyl)methyl]-1,3,5-triazine-2,4,6-triamine
CID 80764929
6-hydrazinyl-2-N,4-N,4-N-trimethyl-2-N-(2-methylbutyl)-1,3,5-triazine-2,4-diamine
CID 80895012
2-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-methylamino]-N-propan-2-ylacetamide
CID 80901609

Frequently Asked Questions

What is the IUPAC name of 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine (CID 80917534) is 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine is CN(C)c1nc(NN)nc(N(C)Cc2ccccc2)n1.
What is the InChIKey of 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is GUQJOCQMJNKQCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7/c1-19(2)12-15-11(18-14)16-13(17-12)20(3)9-10-7-5-4-6-8-10/h4-8H,9,14H2,1-3H3,(H,15,16,17,18).
What are the key properties of 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 273.34 g/mol, XLogP of 0.86, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80917534), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).