[6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine

C11H18N4O4 — CID 114071599

IUPAC[6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine
SMILESCC(C)COCCOc1cc([N+](=O)[O-])cc(NN)n1
InChIInChI=1S/C11H18N4O4/c1-8(2)7-18-3-4-19-11-6-9(15(16)17)5-10(13-11)14-12/h5-6,8H,3-4,7,12H2,1-2H3,(H,13,14)
InChIKeyISBPLBJJFYGATP-UHFFFAOYSA-N
MW270.29 g/mol
LogP1.33
Rot. Bonds8

About [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine

[6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine (PubChem CID 114071599) has the molecular formula C11H18N4O4 and a molecular weight of 270.29 g/mol. Its IUPAC name is [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine
PubChem CID114071599
Molecular FormulaC11H18N4O4
Molecular Weight270.29 g/mol
Exact Mass270.13
IUPAC Name[6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine
SMILESCC(C)COCCOc1cc([N+](=O)[O-])cc(NN)n1
InChIInChI=1S/C11H18N4O4/c1-8(2)7-18-3-4-19-11-6-9(15(16)17)5-10(13-11)14-12/h5-6,8H,3-4,7,12H2,1-2H3,(H,13,14)
InChIKeyISBPLBJJFYGATP-UHFFFAOYSA-N
XLogP1.33
TPSA112.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', '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 [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine?
The IUPAC name of [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine (CID 114071599) is [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine?
The canonical SMILES for [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine is CC(C)COCCOc1cc([N+](=O)[O-])cc(NN)n1.
What is the InChIKey of [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine?
The InChIKey is ISBPLBJJFYGATP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O4/c1-8(2)7-18-3-4-19-11-6-9(15(16)17)5-10(13-11)14-12/h5-6,8H,3-4,7,12H2,1-2H3,(H,13,14).
What are the key properties of [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine?
[6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine has a molecular weight of 270.29 g/mol, XLogP of 1.33, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[2-(2-methylpropoxy)ethoxy]-4-nitro-2-pyridinyl]hydrazine is sourced from PubChem (CID 114071599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).