[1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine

C12H19ClN2O — CID 105271035

IUPAC[1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine
SMILESCCOC(CC)C(NN)c1ccc(Cl)cc1
InChIInChI=1S/C12H19ClN2O/c1-3-11(16-4-2)12(15-14)9-5-7-10(13)8-6-9/h5-8,11-12,15H,3-4,14H2,1-2H3
InChIKeyKUAGUGBKTWBIMD-UHFFFAOYSA-N
MW242.75 g/mol
LogP2.66
Rot. Bonds6

About [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine

[1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine (PubChem CID 105271035) has the molecular formula C12H19ClN2O and a molecular weight of 242.75 g/mol. Its IUPAC name is [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine
PubChem CID105271035
Molecular FormulaC12H19ClN2O
Molecular Weight242.75 g/mol
Exact Mass242.12
IUPAC Name[1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine
SMILESCCOC(CC)C(NN)c1ccc(Cl)cc1
InChIInChI=1S/C12H19ClN2O/c1-3-11(16-4-2)12(15-14)9-5-7-10(13)8-6-9/h5-8,11-12,15H,3-4,14H2,1-2H3
InChIKeyKUAGUGBKTWBIMD-UHFFFAOYSA-N
XLogP2.66
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.75
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[1-(3,4-dichlorophenyl)-2-ethoxybutyl]hydrazine
CID 105271084
[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine
CID 105279275
[1-(5-chlorothiophen-2-yl)-2-ethoxybutyl]hydrazine
CID 105271107
[2-ethoxy-1-(4-ethylphenyl)pentyl]hydrazine
CID 105271510
[1-(4-chloro-1-methylpyrazol-5-yl)-2-ethoxybutyl]hydrazine
CID 105271122
2-ethoxy-N-ethyl-1-(4-ethylphenyl)butan-1-amine
CID 116716895
[2-ethoxy-1-(4-propan-2-yloxyphenyl)pentyl]hydrazine
CID 105271540
[2-ethoxy-1-(3-fluoro-4-pyridinyl)butyl]hydrazine
CID 105271066
1-(4-tert-butylphenyl)-2-ethoxy-N-methylbutan-1-amine
CID 116716499
(1S)-1-(4-chlorophenyl)-2,2-diethoxyethanamine
CID 162516854
[2-ethoxy-1-(2-methylpyrazol-3-yl)butyl]hydrazine
CID 105270924
[1-(4-chlorophenyl)-2-ethoxyethyl]hydrazine
CID 105193288

Frequently Asked Questions

What is the IUPAC name of [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine?
The IUPAC name of [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine (CID 105271035) is [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine.
What is the SMILES notation for [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine?
The canonical SMILES for [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine is CCOC(CC)C(NN)c1ccc(Cl)cc1.
What is the InChIKey of [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine?
The InChIKey is KUAGUGBKTWBIMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19ClN2O/c1-3-11(16-4-2)12(15-14)9-5-7-10(13)8-6-9/h5-8,11-12,15H,3-4,14H2,1-2H3.
What are the key properties of [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine?
[1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine has a molecular weight of 242.75 g/mol, XLogP of 2.66, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-chlorophenyl)-2-ethoxybutyl]hydrazine is sourced from PubChem (CID 105271035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).