[6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine

C9H10N6O3 — CID 116794577

IUPAC[6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine
SMILESCn1cc(Oc2nc(NN)ccc2[N+](=O)[O-])cn1
InChIInChI=1S/C9H10N6O3/c1-14-5-6(4-11-14)18-9-7(15(16)17)2-3-8(12-9)13-10/h2-5H,10H2,1H3,(H,12,13)
InChIKeyVBTDDJRUHHOHLE-UHFFFAOYSA-N
MW250.22 g/mol
LogP0.80
Rot. Bonds4

About [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine

[6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine (PubChem CID 116794577) has the molecular formula C9H10N6O3 and a molecular weight of 250.22 g/mol. Its IUPAC name is [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine.

Molecular Properties

Compound Name[6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine
PubChem CID116794577
Molecular FormulaC9H10N6O3
Molecular Weight250.22 g/mol
Exact Mass250.08
IUPAC Name[6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine
SMILESCn1cc(Oc2nc(NN)ccc2[N+](=O)[O-])cn1
InChIInChI=1S/C9H10N6O3/c1-14-5-6(4-11-14)18-9-7(15(16)17)2-3-8(12-9)13-10/h2-5H,10H2,1H3,(H,12,13)
InChIKeyVBTDDJRUHHOHLE-UHFFFAOYSA-N
XLogP0.80
TPSA121.13 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.22
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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-(4-chlorophenoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80915190
[6-(1-methylpyrazol-4-yl)oxy-2-pyridinyl]hydrazine
CID 116794539
5-methyl-2-(1-methylpyrazol-4-yl)oxy-3-nitropyridine
CID 100731820
(5-nitro-6-propan-2-yloxy-2-pyridinyl)hydrazine
CID 80911273
4-(3-methoxy-4-nitrophenoxy)-1-methylpyrazole
CID 154676943
[6-(4-bromo-2-chlorophenoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80916853
N-methyl-6-(4-methylphenoxy)-5-nitropyridin-2-amine
CID 80862408
6-(4-fluorophenoxy)-N-methyl-5-nitropyridin-2-amine
CID 80869880
[6-(cyclopentylmethoxy)-5-nitro-2-pyridinyl]hydrazine
CID 80923785
2-fluoro-4-(1-methylpyrazol-4-yl)oxy-5-nitrobenzoic acid
CID 116792576
N-(3-ethyl-1-methylpyrazol-4-yl)-6-hydrazinyl-3-nitropyridin-2-amine
CID 107465281
N-[(1,3-dimethylpyrazol-4-yl)methyl]-6-hydrazinyl-3-nitropyridin-2-amine
CID 115991964

Frequently Asked Questions

What is the IUPAC name of [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine?
The IUPAC name of [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine (CID 116794577) is [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine.
What is the SMILES notation for [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine?
The canonical SMILES for [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine is Cn1cc(Oc2nc(NN)ccc2[N+](=O)[O-])cn1.
What is the InChIKey of [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine?
The InChIKey is VBTDDJRUHHOHLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N6O3/c1-14-5-6(4-11-14)18-9-7(15(16)17)2-3-8(12-9)13-10/h2-5H,10H2,1H3,(H,12,13).
What are the key properties of [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine?
[6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine has a molecular weight of 250.22 g/mol, XLogP of 0.80, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(1-methylpyrazol-4-yl)oxy-5-nitro-2-pyridinyl]hydrazine is sourced from PubChem (CID 116794577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).