[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine

C16H19ClN2O — CID 105279275

IUPAC[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine
SMILESCCOC(c1ccccc1)C(NN)c1ccc(Cl)cc1
InChIInChI=1S/C16H19ClN2O/c1-2-20-16(13-6-4-3-5-7-13)15(19-18)12-8-10-14(17)11-9-12/h3-11,15-16,19H,2,18H2,1H3
InChIKeySHGDIEONROUIMW-UHFFFAOYSA-N
MW290.79 g/mol
LogP3.62
Rot. Bonds6

About [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine

[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine (PubChem CID 105279275) has the molecular formula C16H19ClN2O and a molecular weight of 290.79 g/mol. Its IUPAC name is [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine
PubChem CID105279275
Molecular FormulaC16H19ClN2O
Molecular Weight290.79 g/mol
Exact Mass290.12
IUPAC Name[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine
SMILESCCOC(c1ccccc1)C(NN)c1ccc(Cl)cc1
InChIInChI=1S/C16H19ClN2O/c1-2-20-16(13-6-4-3-5-7-13)15(19-18)12-8-10-14(17)11-9-12/h3-11,15-16,19H,2,18H2,1H3
InChIKeySHGDIEONROUIMW-UHFFFAOYSA-N
XLogP3.62
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.79
LogP ≤ 53.62
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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Frequently Asked Questions

What is the IUPAC name of [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine?
The IUPAC name of [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine (CID 105279275) is [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine.
What is the SMILES notation for [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine?
The canonical SMILES for [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine is CCOC(c1ccccc1)C(NN)c1ccc(Cl)cc1.
What is the InChIKey of [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine?
The InChIKey is SHGDIEONROUIMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O/c1-2-20-16(13-6-4-3-5-7-13)15(19-18)12-8-10-14(17)11-9-12/h3-11,15-16,19H,2,18H2,1H3.
What are the key properties of [1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine?
[1-(4-chlorophenyl)-2-ethoxy-2-phenylethyl]hydrazine has a molecular weight of 290.79 g/mol, XLogP of 3.62, 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-ethoxy-2-phenylethyl]hydrazine is sourced from PubChem (CID 105279275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).