[1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine

C13H22N2OS — CID 105225877

IUPAC[1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)c1ccc(OC)cc1C
InChIInChI=1S/C13H22N2OS/c1-4-7-17-9-13(15-14)12-6-5-11(16-3)8-10(12)2/h5-6,8,13,15H,4,7,9,14H2,1-3H3
InChIKeyGOUMSKMPVMUOIN-UHFFFAOYSA-N
MW254.40 g/mol
LogP2.65
Rot. Bonds7

About [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine

[1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine (PubChem CID 105225877) has the molecular formula C13H22N2OS and a molecular weight of 254.40 g/mol. Its IUPAC name is [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine.

Molecular Properties

Compound Name[1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine
PubChem CID105225877
Molecular FormulaC13H22N2OS
Molecular Weight254.40 g/mol
Exact Mass254.15
IUPAC Name[1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine
SMILESCCCSCC(NN)c1ccc(OC)cc1C
InChIInChI=1S/C13H22N2OS/c1-4-7-17-9-13(15-14)12-6-5-11(16-3)8-10(12)2/h5-6,8,13,15H,4,7,9,14H2,1-3H3
InChIKeyGOUMSKMPVMUOIN-UHFFFAOYSA-N
XLogP2.65
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.40
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(2,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine
CID 105225815
[1-(3,5-dimethoxyphenyl)-2-propylsulfanylethyl]hydrazine
CID 105225838
N-ethyl-1-(4-methoxy-2-methylphenyl)-2-(2-methylpropylsulfanyl)ethanamine
CID 65318131
N,N-diethyl-3-hydrazinyl-3-(4-methoxy-2-methylphenyl)propan-1-amine
CID 105244209
1-(2,4-dimethoxyphenyl)-N-ethyl-2-propylsulfanylethanamine
CID 64615524
[2-cyclobutyl-1-(4-methoxy-2-methylphenyl)ethyl]hydrazine
CID 103170431
[3-(2-methoxyethoxy)-1-(4-methoxy-2-methylphenyl)propyl]hydrazine
CID 102930044
1-(2-fluoro-4-methoxyphenyl)-2-propylsulfanylethanol
CID 103395386
[2-ethylsulfanyl-1-(4-fluoro-2-methylphenyl)ethyl]hydrazine
CID 105225304
1-(2,4-dimethylphenyl)-N-ethyl-2-propylsulfanylethanamine
CID 64614075
3-ethylsulfanyl-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 116504533
[1-(4-methoxy-2-methylphenyl)-3-(3-methylphenyl)propyl]hydrazine
CID 105291631

Frequently Asked Questions

What is the IUPAC name of [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine?
The IUPAC name of [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine (CID 105225877) is [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine.
What is the SMILES notation for [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine?
The canonical SMILES for [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine is CCCSCC(NN)c1ccc(OC)cc1C.
What is the InChIKey of [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine?
The InChIKey is GOUMSKMPVMUOIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2OS/c1-4-7-17-9-13(15-14)12-6-5-11(16-3)8-10(12)2/h5-6,8,13,15H,4,7,9,14H2,1-3H3.
What are the key properties of [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine?
[1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine has a molecular weight of 254.40 g/mol, XLogP of 2.65, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-methoxy-2-methylphenyl)-2-propylsulfanylethyl]hydrazine is sourced from PubChem (CID 105225877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).