[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine

C15H20N2OS — CID 105267339

IUPAC[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCCO1)c1cccc2ccsc12
InChIInChI=1S/C15H20N2OS/c16-17-14(10-12-5-1-2-8-18-12)13-6-3-4-11-7-9-19-15(11)13/h3-4,6-7,9,12,14,17H,1-2,5,8,10,16H2
InChIKeyNOKTVBFHFMHYQW-UHFFFAOYSA-N
MW276.40 g/mol
LogP3.36
Rot. Bonds4

About [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine

[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine (PubChem CID 105267339) has the molecular formula C15H20N2OS and a molecular weight of 276.40 g/mol. Its IUPAC name is [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine
PubChem CID105267339
Molecular FormulaC15H20N2OS
Molecular Weight276.40 g/mol
Exact Mass276.13
IUPAC Name[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine
SMILESNNC(CC1CCCCO1)c1cccc2ccsc12
InChIInChI=1S/C15H20N2OS/c16-17-14(10-12-5-1-2-8-18-12)13-6-3-4-11-7-9-19-15(11)13/h3-4,6-7,9,12,14,17H,1-2,5,8,10,16H2
InChIKeyNOKTVBFHFMHYQW-UHFFFAOYSA-N
XLogP3.36
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.40
LogP ≤ 53.36
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-(1-benzothiophen-7-yl)-N-ethyl-3-(oxan-2-yl)propan-1-amine
CID 105021741
[1-(2-methylphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267276
[1-(1-benzothiophen-7-yl)-2-cyclohexylsulfanylethyl]hydrazine
CID 105227744
[1-(2-methoxyphenyl)-2-(oxan-2-yl)ethyl]hydrazine
CID 105267281
[1-(2,3-difluorophenyl)-2-(oxolan-2-yl)ethyl]hydrazine
CID 105198582
1-(1-benzothiophen-7-yl)-2-cyclopentylethanol
CID 115827369
[1-(2-methylthiophen-3-yl)-3-(oxan-2-yl)propyl]hydrazine
CID 102843428
N-methyl-1-(2-methylthiophen-3-yl)-2-(oxan-2-yl)ethanamine
CID 102833757
3-[1-hydrazinyl-2-(oxan-2-yl)ethyl]pyridin-4-amine
CID 105267384
1-(1-benzothiophen-7-yl)-2-cyclopentylsulfanyl-N-ethylethanamine
CID 81153093
[1-(1-benzothiophen-7-yl)-2-propoxyethyl]hydrazine
CID 105209936
[1-(1-benzothiophen-7-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
CID 105206637

Frequently Asked Questions

What is the IUPAC name of [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine?
The IUPAC name of [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine (CID 105267339) is [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine.
What is the SMILES notation for [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine?
The canonical SMILES for [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine is NNC(CC1CCCCO1)c1cccc2ccsc12.
What is the InChIKey of [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine?
The InChIKey is NOKTVBFHFMHYQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2OS/c16-17-14(10-12-5-1-2-8-18-12)13-6-3-4-11-7-9-19-15(11)13/h3-4,6-7,9,12,14,17H,1-2,5,8,10,16H2.
What are the key properties of [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine?
[1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine has a molecular weight of 276.40 g/mol, XLogP of 3.36, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-benzothiophen-7-yl)-2-(oxan-2-yl)ethyl]hydrazine is sourced from PubChem (CID 105267339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).