N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

C13H24N6O — CID 80927830

IUPACN-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCC(C)Oc1nc(NN)nc(N(C)C2CCCCC2)n1
InChIInChI=1S/C13H24N6O/c1-9(2)20-13-16-11(18-14)15-12(17-13)19(3)10-7-5-4-6-8-10/h9-10H,4-8,14H2,1-3H3,(H,15,16,17,18)
InChIKeyHQYBZAIXCNNQDT-UHFFFAOYSA-N
MW280.38 g/mol
LogP1.71
Rot. Bonds5

About N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 80927830) has the molecular formula C13H24N6O and a molecular weight of 280.38 g/mol. Its IUPAC name is N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID80927830
Molecular FormulaC13H24N6O
Molecular Weight280.38 g/mol
Exact Mass280.20
IUPAC NameN-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCC(C)Oc1nc(NN)nc(N(C)C2CCCCC2)n1
InChIInChI=1S/C13H24N6O/c1-9(2)20-13-16-11(18-14)15-12(17-13)19(3)10-7-5-4-6-8-10/h9-10H,4-8,14H2,1-3H3,(H,15,16,17,18)
InChIKeyHQYBZAIXCNNQDT-UHFFFAOYSA-N
XLogP1.71
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.38
LogP ≤ 51.71
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'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 80927830) is N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is CC(C)Oc1nc(NN)nc(N(C)C2CCCCC2)n1.
What is the InChIKey of N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is HQYBZAIXCNNQDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N6O/c1-9(2)20-13-16-11(18-14)15-12(17-13)19(3)10-7-5-4-6-8-10/h9-10H,4-8,14H2,1-3H3,(H,15,16,17,18).
What are the key properties of N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 280.38 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80927830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).