(1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine

C15H24N2O — CID 105279270

IUPAC(1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine
SMILESC=C(C)CCC(NN)C(OCC)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-4-18-15(13-8-6-5-7-9-13)14(17-16)11-10-12(2)3/h5-9,14-15,17H,2,4,10-11,16H2,1,3H3
InChIKeyGYGQYGMVMZNNFM-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.95
Rot. Bonds8

About (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine

(1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine (PubChem CID 105279270) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine.

Molecular Properties

Compound Name(1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine
PubChem CID105279270
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine
SMILESC=C(C)CCC(NN)C(OCC)c1ccccc1
InChIInChI=1S/C15H24N2O/c1-4-18-15(13-8-6-5-7-9-13)14(17-16)11-10-12(2)3/h5-9,14-15,17H,2,4,10-11,16H2,1,3H3
InChIKeyGYGQYGMVMZNNFM-UHFFFAOYSA-N
XLogP2.95
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine?
The IUPAC name of (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine (CID 105279270) is (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine.
What is the SMILES notation for (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine?
The canonical SMILES for (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine is C=C(C)CCC(NN)C(OCC)c1ccccc1.
What is the InChIKey of (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine?
The InChIKey is GYGQYGMVMZNNFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-18-15(13-8-6-5-7-9-13)14(17-16)11-10-12(2)3/h5-9,14-15,17H,2,4,10-11,16H2,1,3H3.
What are the key properties of (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine?
(1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine has a molecular weight of 248.37 g/mol, XLogP of 2.95, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxy-5-methyl-1-phenylhex-5-en-2-yl)hydrazine is sourced from PubChem (CID 105279270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).