[1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine

C14H22N2OS — CID 105314298

IUPAC[1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
SMILESCSc1ccccc1C(CCC1CCCO1)NN
InChIInChI=1S/C14H22N2OS/c1-18-14-7-3-2-6-12(14)13(16-15)9-8-11-5-4-10-17-11/h2-3,6-7,11,13,16H,4-5,8-10,15H2,1H3
InChIKeyVOZCHTQGNAMFMK-UHFFFAOYSA-N
MW266.41 g/mol
LogP2.87
Rot. Bonds6

About [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine

[1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine (PubChem CID 105314298) has the molecular formula C14H22N2OS and a molecular weight of 266.41 g/mol. Its IUPAC name is [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
PubChem CID105314298
Molecular FormulaC14H22N2OS
Molecular Weight266.41 g/mol
Exact Mass266.15
IUPAC Name[1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
SMILESCSc1ccccc1C(CCC1CCCO1)NN
InChIInChI=1S/C14H22N2OS/c1-18-14-7-3-2-6-12(14)13(16-15)9-8-11-5-4-10-17-11/h2-3,6-7,11,13,16H,4-5,8-10,15H2,1H3
InChIKeyVOZCHTQGNAMFMK-UHFFFAOYSA-N
XLogP2.87
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.41
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-(2-iodophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314283
1-(2-methylsulfanylphenyl)-4-(oxolan-2-yl)butan-1-amine
CID 104993443
[1-(2-methylfuran-3-yl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105269010
[3-(oxan-2-yl)-1-[2-(trifluoromethyl)phenyl]propyl]hydrazine
CID 105304775
[1-(2,3-dimethylphenyl)-4-(oxolan-2-yl)butyl]hydrazine
CID 105314004
[1-(3-bromo-2-chlorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314342
[1-(2-fluoro-4-methylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314262
[1-(2,5-difluorophenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105219360
[1-(2-fluoro-3-methoxyphenyl)-3-(oxan-2-yl)propyl]hydrazine
CID 105329262
[1-(5-chloro-2-methylphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105314404
[1-(2-fluoro-4-methoxyphenyl)-3-(oxolan-2-yl)propyl]hydrazine
CID 105256870
2-(2-methylphenyl)-4-(oxolan-2-yl)butan-1-amine
CID 79421800

Frequently Asked Questions

What is the IUPAC name of [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine?
The IUPAC name of [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine (CID 105314298) is [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine.
What is the SMILES notation for [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine?
The canonical SMILES for [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine is CSc1ccccc1C(CCC1CCCO1)NN.
What is the InChIKey of [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine?
The InChIKey is VOZCHTQGNAMFMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2OS/c1-18-14-7-3-2-6-12(14)13(16-15)9-8-11-5-4-10-17-11/h2-3,6-7,11,13,16H,4-5,8-10,15H2,1H3.
What are the key properties of [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine?
[1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine has a molecular weight of 266.41 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methylsulfanylphenyl)-3-(oxolan-2-yl)propyl]hydrazine is sourced from PubChem (CID 105314298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).