[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine

C12H18N2O2 — CID 116876261

IUPAC[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine
SMILESCOc1cc(C)c(C2(NN)COC2)cc1C
InChIInChI=1S/C12H18N2O2/c1-8-5-11(15-3)9(2)4-10(8)12(14-13)6-16-7-12/h4-5,14H,6-7,13H2,1-3H3
InChIKeyHOSGTZJPPCUCFV-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.00
Rot. Bonds3

About [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine

[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine (PubChem CID 116876261) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine.

Molecular Properties

Compound Name[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine
PubChem CID116876261
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine
SMILESCOc1cc(C)c(C2(NN)COC2)cc1C
InChIInChI=1S/C12H18N2O2/c1-8-5-11(15-3)9(2)4-10(8)12(14-13)6-16-7-12/h4-5,14H,6-7,13H2,1-3H3
InChIKeyHOSGTZJPPCUCFV-UHFFFAOYSA-N
XLogP1.00
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

3-chloro-3-(4-methoxy-2,5-dimethylphenyl)oxetane
CID 116876485
2-[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]-N-methylpropan-2-amine
CID 116872267
methyl 2-[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]acetate
CID 116873446
2-[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]propanoic acid
CID 116872053
4-[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]butan-2-one
CID 116873901
3-(2-methoxy-4,6-dimethylphenyl)-N-methyloxetan-3-amine
CID 116872794
3-[3-(2-methoxy-4,5-dimethylphenyl)oxetan-3-yl]propan-1-amine
CID 116870043
3-(2-methoxy-4,5-dimethylphenyl)-3-(trifluoromethyl)oxetane
CID 116875861
1,4-dimethoxy-2,5-dimethylbenzene;dihydrochloride
CID 172845974
ethyl 3-(2-methoxy-4,5-dimethylphenyl)oxetane-3-carboxylate
CID 116875799
[1-[3-(2-methoxy-4,5-dimethylphenyl)oxetan-3-yl]cyclopropyl]methanol
CID 116874726
1-[3-(4,5-dimethoxy-2-methylphenyl)oxetan-3-yl]ethanone
CID 116873741

Frequently Asked Questions

What is the IUPAC name of [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine?
The IUPAC name of [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine (CID 116876261) is [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine.
What is the SMILES notation for [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine?
The canonical SMILES for [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine is COc1cc(C)c(C2(NN)COC2)cc1C.
What is the InChIKey of [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine?
The InChIKey is HOSGTZJPPCUCFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-8-5-11(15-3)9(2)4-10(8)12(14-13)6-16-7-12/h4-5,14H,6-7,13H2,1-3H3.
What are the key properties of [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine?
[3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine has a molecular weight of 222.29 g/mol, XLogP of 1.00, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(4-methoxy-2,5-dimethylphenyl)oxetan-3-yl]hydrazine is sourced from PubChem (CID 116876261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).