[1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine

C13H22N2O — CID 105300605

IUPAC[1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine
SMILESCCOCCC(NN)c1cccc(C)c1C
InChIInChI=1S/C13H22N2O/c1-4-16-9-8-13(15-14)12-7-5-6-10(2)11(12)3/h5-7,13,15H,4,8-9,14H2,1-3H3
InChIKeyIPUKZGVCQYTVCH-UHFFFAOYSA-N
MW222.33 g/mol
LogP2.23
Rot. Bonds6

About [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine

[1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine (PubChem CID 105300605) has the molecular formula C13H22N2O and a molecular weight of 222.33 g/mol. Its IUPAC name is [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine.

Molecular Properties

Compound Name[1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine
PubChem CID105300605
Molecular FormulaC13H22N2O
Molecular Weight222.33 g/mol
Exact Mass222.17
IUPAC Name[1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine
SMILESCCOCCC(NN)c1cccc(C)c1C
InChIInChI=1S/C13H22N2O/c1-4-16-9-8-13(15-14)12-7-5-6-10(2)11(12)3/h5-7,13,15H,4,8-9,14H2,1-3H3
InChIKeyIPUKZGVCQYTVCH-UHFFFAOYSA-N
XLogP2.23
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.33
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-(2,3-dimethylphenyl)-4-methylpentyl]hydrazine
CID 105207464
1-(2,3-dimethylphenyl)heptylhydrazine
CID 105293889
3-(2,3-dimethylphenyl)-3-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105259123
(3-ethoxy-1-isoquinolin-8-ylpropyl)hydrazine
CID 103141619
[1-(2,3-dimethylphenyl)-3-methylidenepentyl]hydrazine
CID 105320228
[1-(2,3-dimethylphenyl)-3-pyridin-4-ylpropyl]hydrazine
CID 105300607
[1-(2,3-dimethylphenyl)-2-ethyl-2-methoxybutyl]hydrazine
CID 105275305
1-(2,3-dimethylphenyl)-3-(2-methoxyethoxy)propan-1-amine
CID 102927761
1-(2,3-dimethylphenyl)-N-ethylhexan-1-amine
CID 115837078
[1-(2,3-dimethylphenyl)-2-thiophen-2-ylethyl]hydrazine
CID 105211766
[1-(2,3-dimethylphenyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314004
1-(2,3-dimethylphenyl)-N-methylpentan-1-amine
CID 79405236

Frequently Asked Questions

What is the IUPAC name of [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine?
The IUPAC name of [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine (CID 105300605) is [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine.
What is the SMILES notation for [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine?
The canonical SMILES for [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine is CCOCCC(NN)c1cccc(C)c1C.
What is the InChIKey of [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine?
The InChIKey is IPUKZGVCQYTVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O/c1-4-16-9-8-13(15-14)12-7-5-6-10(2)11(12)3/h5-7,13,15H,4,8-9,14H2,1-3H3.
What are the key properties of [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine?
[1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine has a molecular weight of 222.33 g/mol, XLogP of 2.23, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,3-dimethylphenyl)-3-ethoxypropyl]hydrazine is sourced from PubChem (CID 105300605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).