[1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine

C15H26N2O — CID 105191999

IUPAC[1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine
SMILESCCOc1cccc(C(CCC(C)(C)C)NN)c1
InChIInChI=1S/C15H26N2O/c1-5-18-13-8-6-7-12(11-13)14(17-16)9-10-15(2,3)4/h6-8,11,14,17H,5,9-10,16H2,1-4H3
InChIKeyQVOSYMANNWSJNL-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.42
Rot. Bonds6

About [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine

[1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine (PubChem CID 105191999) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine.

Molecular Properties

Compound Name[1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine
PubChem CID105191999
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name[1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine
SMILESCCOc1cccc(C(CCC(C)(C)C)NN)c1
InChIInChI=1S/C15H26N2O/c1-5-18-13-8-6-7-12(11-13)14(17-16)9-10-15(2,3)4/h6-8,11,14,17H,5,9-10,16H2,1-4H3
InChIKeyQVOSYMANNWSJNL-UHFFFAOYSA-N
XLogP3.42
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.42
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-ethoxyphenyl)-4,4-dimethylpentan-1-amine
CID 55095433
[1-(3-ethoxyphenyl)-3-phenoxypropyl]hydrazine
CID 105191343
[1-(3-ethoxyphenyl)-3,5,5-trimethylhexyl]hydrazine
CID 105328014
[1-(3-ethoxyphenyl)-4-ethylsulfonylbutyl]hydrazine
CID 105191911
[1-(3-ethoxyphenyl)-2-ethylsulfanylethyl]hydrazine
CID 105225226
[1-(3-ethoxyphenyl)-2-propan-2-ylsulfanylethyl]hydrazine
CID 105225968
(4,4-dimethyl-1-phenylpentyl)hydrazine
CID 105199306
[1-(3-ethoxyphenyl)-3-methylbut-3-enyl]hydrazine
CID 105192051
[1-(3-ethoxyphenyl)-2-methylsulfonylethyl]hydrazine
CID 105328109
[2-(4-bromophenyl)sulfanyl-1-(3-ethoxyphenyl)ethyl]hydrazine
CID 105235869
(1S)-1-(3-ethoxyphenyl)-2,2-dimethylpropan-1-amine
CID 94424615
[1-(3-ethoxyphenyl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 105192057

Frequently Asked Questions

What is the IUPAC name of [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine?
The IUPAC name of [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine (CID 105191999) is [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine.
What is the SMILES notation for [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine?
The canonical SMILES for [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine is CCOc1cccc(C(CCC(C)(C)C)NN)c1.
What is the InChIKey of [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine?
The InChIKey is QVOSYMANNWSJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-5-18-13-8-6-7-12(11-13)14(17-16)9-10-15(2,3)4/h6-8,11,14,17H,5,9-10,16H2,1-4H3.
What are the key properties of [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine?
[1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine has a molecular weight of 250.39 g/mol, XLogP of 3.42, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-ethoxyphenyl)-4,4-dimethylpentyl]hydrazine is sourced from PubChem (CID 105191999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).