[4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine

C11H15N5O3 — CID 80909640

IUPAC[4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCCCOc1nc(NN)nc(OCc2ccco2)n1
InChIInChI=1S/C11H15N5O3/c1-2-5-18-10-13-9(16-12)14-11(15-10)19-7-8-4-3-6-17-8/h3-4,6H,2,5,7,12H2,1H3,(H,13,14,15,16)
InChIKeyXHUBNJDZPGLESG-UHFFFAOYSA-N
MW265.27 g/mol
LogP1.12
Rot. Bonds7

About [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine

[4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine (PubChem CID 80909640) has the molecular formula C11H15N5O3 and a molecular weight of 265.27 g/mol. Its IUPAC name is [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
PubChem CID80909640
Molecular FormulaC11H15N5O3
Molecular Weight265.27 g/mol
Exact Mass265.12
IUPAC Name[4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCCCOc1nc(NN)nc(OCc2ccco2)n1
InChIInChI=1S/C11H15N5O3/c1-2-5-18-10-13-9(16-12)14-11(15-10)19-7-8-4-3-6-17-8/h3-4,6H,2,5,7,12H2,1H3,(H,13,14,15,16)
InChIKeyXHUBNJDZPGLESG-UHFFFAOYSA-N
XLogP1.12
TPSA108.32 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.27
LogP ≤ 51.12
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'}

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Frequently Asked Questions

What is the IUPAC name of [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine (CID 80909640) is [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine is CCCOc1nc(NN)nc(OCc2ccco2)n1.
What is the InChIKey of [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is XHUBNJDZPGLESG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O3/c1-2-5-18-10-13-9(16-12)14-11(15-10)19-7-8-4-3-6-17-8/h3-4,6H,2,5,7,12H2,1H3,(H,13,14,15,16).
What are the key properties of [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
[4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 265.27 g/mol, XLogP of 1.12, 7 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(furan-2-ylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 80909640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).