3-methoxy-2-(2-nitrophenoxy)propanehydrazide

C10H13N3O5 — CID 103229219

IUPAC3-methoxy-2-(2-nitrophenoxy)propanehydrazide
SMILESCOCC(Oc1ccccc1[N+](=O)[O-])C(=O)NN
InChIInChI=1S/C10H13N3O5/c1-17-6-9(10(14)12-11)18-8-5-3-2-4-7(8)13(15)16/h2-5,9H,6,11H2,1H3,(H,12,14)
InChIKeyIABJZZPJLWFJHC-UHFFFAOYSA-N
MW255.23 g/mol
LogP-0.02
Rot. Bonds6

About 3-methoxy-2-(2-nitrophenoxy)propanehydrazide

3-methoxy-2-(2-nitrophenoxy)propanehydrazide (PubChem CID 103229219) has the molecular formula C10H13N3O5 and a molecular weight of 255.23 g/mol. Its IUPAC name is 3-methoxy-2-(2-nitrophenoxy)propanehydrazide.

Molecular Properties

Compound Name3-methoxy-2-(2-nitrophenoxy)propanehydrazide
PubChem CID103229219
Molecular FormulaC10H13N3O5
Molecular Weight255.23 g/mol
Exact Mass255.09
IUPAC Name3-methoxy-2-(2-nitrophenoxy)propanehydrazide
SMILESCOCC(Oc1ccccc1[N+](=O)[O-])C(=O)NN
InChIInChI=1S/C10H13N3O5/c1-17-6-9(10(14)12-11)18-8-5-3-2-4-7(8)13(15)16/h2-5,9H,6,11H2,1H3,(H,12,14)
InChIKeyIABJZZPJLWFJHC-UHFFFAOYSA-N
XLogP-0.02
TPSA116.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.23
LogP ≤ 5-0.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', '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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Related Compounds

2-(2-nitrophenoxy)butanehydrazide
CID 54792980
2-(4-chloro-2-nitrophenoxy)-3-methoxypropanehydrazide
CID 103229241
3-methoxy-2-(2-methyl-5-nitrophenoxy)propanehydrazide
CID 103229305
2-(2-fluoro-4-nitrophenoxy)-3-methoxypropanehydrazide
CID 103229297
2-[2-(2-nitrophenoxy)propanoylamino]ethyl nitrate
CID 15839962
2-(2-chloro-4-fluorophenoxy)-3-methoxypropanehydrazide
CID 103229273
2-(2-nitrophenoxy)-N-[8-[2-(2-nitrophenoxy)propanoylamino]octyl]propanamide
CID 17233381
N-[(2S)-1-methoxypropan-2-yl]-2-(2-nitrophenoxy)acetamide
CID 7858942
3-methoxy-2-(5-methyl-2-nitrophenoxy)propanoic acid
CID 103223972
2-[(2-nitro-3-pyridinyl)oxy]butanehydrazide
CID 55213215
2-(2-methyl-6-nitrophenoxy)pentanehydrazide
CID 83048033
(2S)-2-(2-nitrophenoxy)propanoic acid
CID 841636

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2-(2-nitrophenoxy)propanehydrazide?
The IUPAC name of 3-methoxy-2-(2-nitrophenoxy)propanehydrazide (CID 103229219) is 3-methoxy-2-(2-nitrophenoxy)propanehydrazide.
What is the SMILES notation for 3-methoxy-2-(2-nitrophenoxy)propanehydrazide?
The canonical SMILES for 3-methoxy-2-(2-nitrophenoxy)propanehydrazide is COCC(Oc1ccccc1[N+](=O)[O-])C(=O)NN.
What is the InChIKey of 3-methoxy-2-(2-nitrophenoxy)propanehydrazide?
The InChIKey is IABJZZPJLWFJHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3O5/c1-17-6-9(10(14)12-11)18-8-5-3-2-4-7(8)13(15)16/h2-5,9H,6,11H2,1H3,(H,12,14).
What are the key properties of 3-methoxy-2-(2-nitrophenoxy)propanehydrazide?
3-methoxy-2-(2-nitrophenoxy)propanehydrazide has a molecular weight of 255.23 g/mol, XLogP of -0.02, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2-(2-nitrophenoxy)propanehydrazide is sourced from PubChem (CID 103229219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).