6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine

C13H19N7O — CID 80900883

IUPAC6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
SMILESCOc1ccccc1N(C)c1nc(NN)nc(N(C)C)n1
InChIInChI=1S/C13H19N7O/c1-19(2)12-15-11(18-14)16-13(17-12)20(3)9-7-5-6-8-10(9)21-4/h5-8H,14H2,1-4H3,(H,15,16,17,18)
InChIKeySXBUNACCNLIUOQ-UHFFFAOYSA-N
MW289.34 g/mol
LogP1.00
Rot. Bonds5

About 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine

6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 80900883) has the molecular formula C13H19N7O and a molecular weight of 289.34 g/mol. Its IUPAC name is 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
PubChem CID80900883
Molecular FormulaC13H19N7O
Molecular Weight289.34 g/mol
Exact Mass289.17
IUPAC Name6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
SMILESCOc1ccccc1N(C)c1nc(NN)nc(N(C)C)n1
InChIInChI=1S/C13H19N7O/c1-19(2)12-15-11(18-14)16-13(17-12)20(3)9-7-5-6-8-10(9)21-4/h5-8H,14H2,1-4H3,(H,15,16,17,18)
InChIKeySXBUNACCNLIUOQ-UHFFFAOYSA-N
XLogP1.00
TPSA92.43 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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

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Related Compounds

6-hydrazinyl-2-N,4-N,4-N-trimethyl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 80927617
4-(2-fluorophenoxy)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 80915893
2-hydrazinyl-N-(2-methoxyphenyl)-N-methylthieno[2,3-d]pyrimidin-4-amine
CID 103333298
6-chloro-2-N-(2-methoxyphenyl)-2-N-methyl-1,3,5-triazine-2,4-diamine
CID 80816535
2-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]oxy]benzonitrile
CID 80918439
4-hydrazinyl-6-methoxy-N-methyl-N-phenyl-1,3,5-triazin-2-amine
CID 80927383
2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80917534
4-(2,3-dichlorophenoxy)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 80916635
3,5-dichloro-6-hydrazinyl-N-(2-methoxyphenyl)-N-methylpyridin-2-amine
CID 102761927
2-N-ethyl-6-hydrazinyl-4-N,4-N-dimethyl-2-N-phenyl-1,3,5-triazine-2,4-diamine
CID 80918358
4-hydrazinyl-N,N-dimethyl-6-phenylsulfanyl-1,3,5-triazin-2-amine
CID 80925510
4-hydrazinyl-6-(4-methoxyphenyl)sulfanyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 80931212

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine (CID 80900883) is 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine is COc1ccccc1N(C)c1nc(NN)nc(N(C)C)n1.
What is the InChIKey of 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is SXBUNACCNLIUOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7O/c1-19(2)12-15-11(18-14)16-13(17-12)20(3)9-7-5-6-8-10(9)21-4/h5-8H,14H2,1-4H3,(H,15,16,17,18).
What are the key properties of 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 289.34 g/mol, XLogP of 1.00, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-2-N-(2-methoxyphenyl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80900883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).