[5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine

C11H16N4O4 — CID 80925762

IUPAC[5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine
SMILESNNc1ccc([N+](=O)[O-])c(OCC2CCOCC2)n1
InChIInChI=1S/C11H16N4O4/c12-14-10-2-1-9(15(16)17)11(13-10)19-7-8-3-5-18-6-4-8/h1-2,8H,3-7,12H2,(H,13,14)
InChIKeyCGHBQHNALXITAI-UHFFFAOYSA-N
MW268.27 g/mol
LogP1.08
Rot. Bonds5

About [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine

[5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine (PubChem CID 80925762) has the molecular formula C11H16N4O4 and a molecular weight of 268.27 g/mol. Its IUPAC name is [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine
PubChem CID80925762
Molecular FormulaC11H16N4O4
Molecular Weight268.27 g/mol
Exact Mass268.12
IUPAC Name[5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine
SMILESNNc1ccc([N+](=O)[O-])c(OCC2CCOCC2)n1
InChIInChI=1S/C11H16N4O4/c12-14-10-2-1-9(15(16)17)11(13-10)19-7-8-3-5-18-6-4-8/h1-2,8H,3-7,12H2,(H,13,14)
InChIKeyCGHBQHNALXITAI-UHFFFAOYSA-N
XLogP1.08
TPSA112.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 51.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'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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Related Compounds

[6-(cyclopentylmethoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80923785
methyl 5-nitro-6-(oxan-4-ylmethoxy)pyridine-2-carboxylate
CID 114403273
6-(cyclopentylmethoxy)-N-ethyl-5-nitropyridin-2-amine
CID 80878288
4-nitro-3-(oxan-4-ylmethoxy)benzaldehyde
CID 62385138
(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine
CID 80911273
[6-(oxan-4-ylmethoxy)pyrazin-2-yl]hydrazine
CID 80924977
2-nitro-3-(oxan-4-ylmethoxy)aniline
CID 80879794
5-nitro-6-(oxolan-2-ylmethoxy)pyridin-2-amine
CID 80859627
6-hydrazinyl-N-methyl-3-nitro-N-(oxolan-3-yl)pyridin-2-amine
CID 82747704
[5-(oxan-4-ylmethoxymethyl)-2-pyridinyl]hydrazine
CID 62385083
N-ethyl-6-hydrazinyl-3-nitropyridin-2-amine
CID 80932567
[6-(4-chlorophenoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80915190

Frequently Asked Questions

What is the IUPAC name of [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine?
The IUPAC name of [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine (CID 80925762) is [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine.
What is the SMILES notation for [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine?
The canonical SMILES for [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine is NNc1ccc([N+](=O)[O-])c(OCC2CCOCC2)n1.
What is the InChIKey of [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine?
The InChIKey is CGHBQHNALXITAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O4/c12-14-10-2-1-9(15(16)17)11(13-10)19-7-8-3-5-18-6-4-8/h1-2,8H,3-7,12H2,(H,13,14).
What are the key properties of [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine?
[5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine has a molecular weight of 268.27 g/mol, XLogP of 1.08, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [5-nitro-6-(oxan-4-ylmethoxy)-2-pyridinyl]hydrazine is sourced from PubChem (CID 80925762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).