[3-methyl-1-(3-propoxyphenyl)butyl]hydrazine

C14H24N2O — CID 105282817

IUPAC[3-methyl-1-(3-propoxyphenyl)butyl]hydrazine
SMILESCCCOc1cccc(C(CC(C)C)NN)c1
InChIInChI=1S/C14H24N2O/c1-4-8-17-13-7-5-6-12(10-13)14(16-15)9-11(2)3/h5-7,10-11,14,16H,4,8-9,15H2,1-3H3
InChIKeyXVNWAMXQLXMNJQ-UHFFFAOYSA-N
MW236.36 g/mol
LogP3.03
Rot. Bonds7

About [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine

[3-methyl-1-(3-propoxyphenyl)butyl]hydrazine (PubChem CID 105282817) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine.

Molecular Properties

Compound Name[3-methyl-1-(3-propoxyphenyl)butyl]hydrazine
PubChem CID105282817
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name[3-methyl-1-(3-propoxyphenyl)butyl]hydrazine
SMILESCCCOc1cccc(C(CC(C)C)NN)c1
InChIInChI=1S/C14H24N2O/c1-4-8-17-13-7-5-6-12(10-13)14(16-15)9-11(2)3/h5-7,10-11,14,16H,4,8-9,15H2,1-3H3
InChIKeyXVNWAMXQLXMNJQ-UHFFFAOYSA-N
XLogP3.03
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 53.03
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

[2-propan-2-yloxy-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105323803
[2-(4-iodophenyl)-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105310368
[1-(3-cyclopropyloxyphenyl)-3-methylbutyl]hydrazine
CID 105199146
1-(3-propoxyphenyl)prop-2-ynylhydrazine
CID 105315638
N-methyl-1-(3-propoxyphenyl)ethanamine
CID 43279892
N-methyl-1-(3-propoxyphenyl)propan-1-amine
CID 114979549
[2-(4-bromothiophen-2-yl)-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105299378
[1-(3-ethoxyphenyl)-3-phenoxypropyl]hydrazine
CID 105191343
[1-(3-ethoxyphenyl)-3,5,5-trimethylhexyl]hydrazine
CID 105328014
[(2-methylphenyl)-(3-propoxyphenyl)methyl]hydrazine
CID 105286114
[2-(5-bromo-3-pyridinyl)-1-(3-propoxyphenyl)ethyl]hydrazine
CID 105334826
(1R)-1-(3-propoxyphenyl)ethane-1,2-diamine
CID 66516554

Frequently Asked Questions

What is the IUPAC name of [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine?
The IUPAC name of [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine (CID 105282817) is [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine.
What is the SMILES notation for [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine?
The canonical SMILES for [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine is CCCOc1cccc(C(CC(C)C)NN)c1.
What is the InChIKey of [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine?
The InChIKey is XVNWAMXQLXMNJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-8-17-13-7-5-6-12(10-13)14(16-15)9-11(2)3/h5-7,10-11,14,16H,4,8-9,15H2,1-3H3.
What are the key properties of [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine?
[3-methyl-1-(3-propoxyphenyl)butyl]hydrazine has a molecular weight of 236.36 g/mol, XLogP of 3.03, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-methyl-1-(3-propoxyphenyl)butyl]hydrazine is sourced from PubChem (CID 105282817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).