1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide

C13H18N2O2 — CID 116844292

IUPAC1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide
SMILESCCOc1ccc(C2(C(=O)NN)CCC2)cc1
InChIInChI=1S/C13H18N2O2/c1-2-17-11-6-4-10(5-7-11)13(8-3-9-13)12(16)15-14/h4-7H,2-3,8-9,14H2,1H3,(H,15,16)
InChIKeyOEOLGVWGBGCOLP-UHFFFAOYSA-N
MW234.30 g/mol
LogP1.50
Rot. Bonds4

About 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide

1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide (PubChem CID 116844292) has the molecular formula C13H18N2O2 and a molecular weight of 234.30 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide
PubChem CID116844292
Molecular FormulaC13H18N2O2
Molecular Weight234.30 g/mol
Exact Mass234.14
IUPAC Name1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide
SMILESCCOc1ccc(C2(C(=O)NN)CCC2)cc1
InChIInChI=1S/C13H18N2O2/c1-2-17-11-6-4-10(5-7-11)13(8-3-9-13)12(16)15-14/h4-7H,2-3,8-9,14H2,1H3,(H,15,16)
InChIKeyOEOLGVWGBGCOLP-UHFFFAOYSA-N
XLogP1.50
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethyl 1-(4-ethoxyphenyl)cyclobutane-1-carboxylate
CID 71404430
1-(4-ethylphenyl)cyclobutane-1-carbohydrazide
CID 116844257
1-(4-ethoxyphenyl)cycloheptane-1-carboxylic acid
CID 28937797
N-(4-ethoxyphenyl)-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 94829289
6-(4-ethoxyphenyl)-3,4a,5,7,8,8a-hexahydro-2H-benzo[b][1,4]dioxine-6-carbohydrazide
CID 70127798
1-(4-methylsulfanylphenyl)cyclobutane-1-carbohydrazide
CID 116844330
(4-ethoxyphenyl)-(1-phenylcyclobutyl)methanone
CID 63410078
1-(4-ethylsulfonylphenyl)cyclopropane-1-carbohydrazide
CID 116844192
2-(4-ethoxyphenyl)spiro[3.3]heptan-2-amine
CID 65009061
1-(4-fluorophenyl)-N-(4-propoxyphenyl)cyclobutane-1-carboxamide
CID 110439215
N-ethyl-1-(4-methoxyphenyl)cyclopentane-1-carboxamide
CID 110487274
N-(2-hydroxyethyl)-1-(4-propoxyphenyl)cyclopentane-1-carboxamide
CID 56692662

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide?
The IUPAC name of 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide (CID 116844292) is 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide.
What is the SMILES notation for 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide?
The canonical SMILES for 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide is CCOc1ccc(C2(C(=O)NN)CCC2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide?
The InChIKey is OEOLGVWGBGCOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O2/c1-2-17-11-6-4-10(5-7-11)13(8-3-9-13)12(16)15-14/h4-7H,2-3,8-9,14H2,1H3,(H,15,16).
What are the key properties of 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide?
1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide has a molecular weight of 234.30 g/mol, XLogP of 1.50, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethoxyphenyl)cyclobutane-1-carbohydrazide is sourced from PubChem (CID 116844292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).