4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine

C13H25N7O — CID 104961882

IUPAC4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
SMILESCCN(CC)c1nc(NN)nc(N2C[C@@H](C)O[C@@H](C)C2)n1
InChIInChI=1S/C13H25N7O/c1-5-19(6-2)12-15-11(18-14)16-13(17-12)20-7-9(3)21-10(4)8-20/h9-10H,5-8,14H2,1-4H3,(H,15,16,17,18)/t9-,10+
InChIKeyKQEMLKANWOSXCP-AOOOYVTPSA-N
MW295.39 g/mol
LogP0.62
Rot. Bonds5

About 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine

4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine (PubChem CID 104961882) has the molecular formula C13H25N7O and a molecular weight of 295.39 g/mol. Its IUPAC name is 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
PubChem CID104961882
Molecular FormulaC13H25N7O
Molecular Weight295.39 g/mol
Exact Mass295.21
IUPAC Name4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
SMILESCCN(CC)c1nc(NN)nc(N2C[C@@H](C)O[C@@H](C)C2)n1
InChIInChI=1S/C13H25N7O/c1-5-19(6-2)12-15-11(18-14)16-13(17-12)20-7-9(3)21-10(4)8-20/h9-10H,5-8,14H2,1-4H3,(H,15,16,17,18)/t9-,10+
InChIKeyKQEMLKANWOSXCP-AOOOYVTPSA-N
XLogP0.62
TPSA92.43 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 50.62
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 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-(3,3-dimethylpyrrolidin-1-yl)-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
CID 80928977
[4-(2,6-dimethylmorpholin-4-yl)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 80928474
6-(2,6-dimethylmorpholin-4-yl)-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80764948
[4-(4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-yl)-6-methylmorpholin-2-yl]methanol
CID 102939211
2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-4-N-(oxan-4-yl)-1,3,5-triazine-2,4-diamine
CID 80898529
4-(3,4-dimethoxypyrrolidin-1-yl)-6-hydrazinyl-N,N-dimethyl-1,3,5-triazin-2-amine
CID 103542142
2-[[4-(diethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-ethylamino]ethanol
CID 80899174
4-chloro-N,N-diethyl-6-(2-methylmorpholin-4-yl)-1,3,5-triazin-2-amine
CID 55124481
1-[4-amino-6-(diethylamino)-1,3,5-triazin-2-yl]pyrrolidine-3,4-diol
CID 106674471
2-N-(2,3-dimethylcyclopentyl)-4-N,4-N-diethyl-6-hydrazinyl-1,3,5-triazine-2,4-diamine
CID 80909767
4-[4-(diethylamino)-6-(methylamino)-1,3,5-triazin-2-yl]morpholine-2-carbonitrile
CID 80837471
4-N,4-N-diethyl-6-hydrazinyl-2-N-(2-methylcyclohexyl)-1,3,5-triazine-2,4-diamine
CID 80938212

Frequently Asked Questions

What is the IUPAC name of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
The IUPAC name of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine (CID 104961882) is 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine is CCN(CC)c1nc(NN)nc(N2C[C@@H](C)O[C@@H](C)C2)n1.
What is the InChIKey of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
The InChIKey is KQEMLKANWOSXCP-AOOOYVTPSA-N. The full InChI is InChI=1S/C13H25N7O/c1-5-19(6-2)12-15-11(18-14)16-13(17-12)20-7-9(3)21-10(4)8-20/h9-10H,5-8,14H2,1-4H3,(H,15,16,17,18)/t9-,10+.
What are the key properties of 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine?
4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine has a molecular weight of 295.39 g/mol, XLogP of 0.62, 5 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 104961882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).