[4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine

C14H20N4O2 — CID 106451624

IUPAC[4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine
SMILESCC(C)COCCOc1nc(NN)nc2ccccc12
InChIInChI=1S/C14H20N4O2/c1-10(2)9-19-7-8-20-13-11-5-3-4-6-12(11)16-14(17-13)18-15/h3-6,10H,7-9,15H2,1-2H3,(H,16,17,18)
InChIKeyAAGSNAZNYWAIJO-UHFFFAOYSA-N
MW276.34 g/mol
LogP1.97
Rot. Bonds7

About [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine

[4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine (PubChem CID 106451624) has the molecular formula C14H20N4O2 and a molecular weight of 276.34 g/mol. Its IUPAC name is [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine
PubChem CID106451624
Molecular FormulaC14H20N4O2
Molecular Weight276.34 g/mol
Exact Mass276.16
IUPAC Name[4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine
SMILESCC(C)COCCOc1nc(NN)nc2ccccc12
InChIInChI=1S/C14H20N4O2/c1-10(2)9-19-7-8-20-13-11-5-3-4-6-12(11)16-14(17-13)18-15/h3-6,10H,7-9,15H2,1-2H3,(H,16,17,18)
InChIKeyAAGSNAZNYWAIJO-UHFFFAOYSA-N
XLogP1.97
TPSA82.29 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 51.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine?
The IUPAC name of [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine (CID 106451624) is [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine.
What is the SMILES notation for [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine?
The canonical SMILES for [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine is CC(C)COCCOc1nc(NN)nc2ccccc12.
What is the InChIKey of [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine?
The InChIKey is AAGSNAZNYWAIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N4O2/c1-10(2)9-19-7-8-20-13-11-5-3-4-6-12(11)16-14(17-13)18-15/h3-6,10H,7-9,15H2,1-2H3,(H,16,17,18).
What are the key properties of [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine?
[4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine has a molecular weight of 276.34 g/mol, XLogP of 1.97, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[2-(2-methylpropoxy)ethoxy]quinazolin-2-yl]hydrazine is sourced from PubChem (CID 106451624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).