4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine

C12H24N6OS — CID 115988847

IUPAC4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NN)nc(N(C)C(CC)CSC)n1
InChIInChI=1S/C12H24N6OS/c1-5-7-19-12-15-10(17-13)14-11(16-12)18(3)9(6-2)8-20-4/h9H,5-8,13H2,1-4H3,(H,14,15,16,17)
InChIKeyJAVZEBQDHBWRAZ-UHFFFAOYSA-N
MW300.43 g/mol
LogP1.52
Rot. Bonds9

About 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine

4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine (PubChem CID 115988847) has the molecular formula C12H24N6OS and a molecular weight of 300.43 g/mol. Its IUPAC name is 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine
PubChem CID115988847
Molecular FormulaC12H24N6OS
Molecular Weight300.43 g/mol
Exact Mass300.17
IUPAC Name4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NN)nc(N(C)C(CC)CSC)n1
InChIInChI=1S/C12H24N6OS/c1-5-7-19-12-15-10(17-13)14-11(16-12)18(3)9(6-2)8-20-4/h9H,5-8,13H2,1-4H3,(H,14,15,16,17)
InChIKeyJAVZEBQDHBWRAZ-UHFFFAOYSA-N
XLogP1.52
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 51.52
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-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-4-hydrazinyl-N-(2-methylbutyl)-6-propoxy-1,3,5-triazin-2-amine
CID 80930026
4-hydrazinyl-N-methyl-6-propoxy-N-(2,2,2-trifluoroethyl)-1,3,5-triazin-2-amine
CID 80899333
4-hydrazinyl-N-methyl-6-propoxy-N-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine
CID 80924992
[4-(2-propan-2-yloxyethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80911471
4-hydrazinyl-N-(2-methylsulfanylethyl)-6-propoxy-1,3,5-triazin-2-amine
CID 80911461
(4-butan-2-ylsulfanyl-6-propoxy-1,3,5-triazin-2-yl)hydrazine
CID 80923930
5-[(4-hydrazinyl-6-propoxy-1,3,5-triazin-2-yl)-methylamino]pentan-1-ol
CID 107207610
2-N,4-N-dimethyl-2-N-(3-methylbutan-2-yl)-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80793836
2-N,4-N,4-N-trimethyl-2-N-(1-methylsulfanylbutan-2-yl)-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 115988791
[4-propoxy-6-(1,1,1-trifluoropropan-2-yloxy)-1,3,5-triazin-2-yl]hydrazine
CID 80923867
4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine
CID 80898353
[4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80909820

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine (CID 115988847) is 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine is CCCOc1nc(NN)nc(N(C)C(CC)CSC)n1.
What is the InChIKey of 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine?
The InChIKey is JAVZEBQDHBWRAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N6OS/c1-5-7-19-12-15-10(17-13)14-11(16-12)18(3)9(6-2)8-20-4/h9H,5-8,13H2,1-4H3,(H,14,15,16,17).
What are the key properties of 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine?
4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine has a molecular weight of 300.43 g/mol, XLogP of 1.52, 9 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 115988847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).