[1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine

C13H22N2O2S — CID 105225815

IUPAC[1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)c1cc(OC)ccc1OC
InChIInChI=1S/C13H22N2O2S/c1-4-7-18-9-12(15-14)11-8-10(16-2)5-6-13(11)17-3/h5-6,8,12,15H,4,7,9,14H2,1-3H3
InChIKeyFHRAZZQYJOHULE-UHFFFAOYSA-N
MW270.40 g/mol
LogP2.35
Rot. Bonds8

About [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine

[1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine (PubChem CID 105225815) has the molecular formula C13H22N2O2S and a molecular weight of 270.40 g/mol. Its IUPAC name is [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine
PubChem CID105225815
Molecular FormulaC13H22N2O2S
Molecular Weight270.40 g/mol
Exact Mass270.14
IUPAC Name[1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)c1cc(OC)ccc1OC
InChIInChI=1S/C13H22N2O2S/c1-4-7-18-9-12(15-14)11-8-10(16-2)5-6-13(11)17-3/h5-6,8,12,15H,4,7,9,14H2,1-3H3
InChIKeyFHRAZZQYJOHULE-UHFFFAOYSA-N
XLogP2.35
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.40
LogP ≤ 52.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine
CID 105225877
[1-(2,5-dimethoxyphenyl)-2-propan-2-ylsulfanylethyl]hydrazine
CID 105226182
1-(2,4-dimethoxyphenyl)-N-ethyl-2-propylsulfanylethanamine
CID 64615524
[1-(3,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine
CID 105225838
1-(2,5-dimethoxyphenyl)-N-ethylpropan-1-amine
CID 43489494
1-(2,5-dimethoxyphenyl)butan-1-amine;hydrochloride
CID 86262898
[(2,5-dimethoxyphenyl)-(4-ethylphenyl)methyl]hydrazine
CID 105197445
[1-(2,5-dimethoxyphenyl)-2-(furan-3-yl)ethyl]hydrazine
CID 105331682
(1S)-1-(2,5-dimethoxyphenyl)pentan-1-amine;hydrochloride
CID 171219764
2-tert-butylsulfanyl-1-(2,5-dimethoxyphenyl)-N-ethylethanamine
CID 64614286
1-(2,4-dimethoxyphenyl)-N-ethyl-2-pentylsulfanylethanamine
CID 107763149
[1-(2,5-dimethoxyphenyl)-2-(oxan-4-yl)ethyl]hydrazine
CID 105298736

Frequently Asked Questions

What is the IUPAC name of [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine?
The IUPAC name of [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine (CID 105225815) is [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine is CCCSCC(NN)c1cc(OC)ccc1OC.
What is the InChIKey of [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine?
The InChIKey is FHRAZZQYJOHULE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2O2S/c1-4-7-18-9-12(15-14)11-8-10(16-2)5-6-13(11)17-3/h5-6,8,12,15H,4,7,9,14H2,1-3H3.
What are the key properties of [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine?
[1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine has a molecular weight of 270.40 g/mol, XLogP of 2.35, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine is sourced from PubChem (CID 105225815), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).