[cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine

C12H16N2S — CID 105314544

IUPAC[cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine
SMILESNNC(C1CC1)C1CSc2ccccc21
InChIInChI=1S/C12H16N2S/c13-14-12(8-5-6-8)10-7-15-11-4-2-1-3-9(10)11/h1-4,8,10,12,14H,5-7,13H2
InChIKeyILJBOKTUEBJNQG-UHFFFAOYSA-N
MW220.34 g/mol
LogP2.12
Rot. Bonds3

About [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine

[cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine (PubChem CID 105314544) has the molecular formula C12H16N2S and a molecular weight of 220.34 g/mol. Its IUPAC name is [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine
PubChem CID105314544
Molecular FormulaC12H16N2S
Molecular Weight220.34 g/mol
Exact Mass220.10
IUPAC Name[cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine
SMILESNNC(C1CC1)C1CSc2ccccc21
InChIInChI=1S/C12H16N2S/c13-14-12(8-5-6-8)10-7-15-11-4-2-1-3-9(10)11/h1-4,8,10,12,14H,5-7,13H2
InChIKeyILJBOKTUEBJNQG-UHFFFAOYSA-N
XLogP2.12
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 52.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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

[2,3-dihydro-1-benzothiophen-3-yl-(3-methylcyclohexyl)methyl]hydrazine
CID 105313541
1-cyclohexyl-1-(2,3-dihydro-1-benzothiophen-3-yl)-N-methylmethanamine
CID 105079433
1-cycloheptyl-1-(2,3-dihydro-1-benzothiophen-3-yl)-N-methylmethanamine
CID 105176241
2-cyclopentyl-1-(2,3-dihydro-1-benzothiophen-3-yl)ethanamine
CID 105138979
[1-(2,3-dihydro-1-benzothiophen-3-yl)-4,4-dimethylpentyl]hydrazine
CID 105300003
[1-(2,3-dihydro-1-benzothiophen-3-yl)-3-methylbut-3-enyl]hydrazine
CID 105319554
[2,3-dihydro-1-benzothiophen-3-yl-(4-methoxyphenyl)methyl]hydrazine
CID 105286232
[2-(2-chlorophenyl)-1-(2,3-dihydro-1-benzothiophen-3-yl)ethyl]hydrazine
CID 105286555
[1-(2,3-dihydro-1-benzothiophen-3-yl)-2-(3-fluorophenyl)ethyl]hydrazine
CID 105286394
[cyclohexyl(3,4-dihydro-2H-chromen-4-yl)methyl]hydrazine
CID 105233788
1-(2,3-dihydro-1-benzothiophen-3-yl)-4-methylpentan-1-amine
CID 105126981
1-(2,3-dihydro-1-benzothiophen-3-yl)but-3-yn-1-amine
CID 105077457

Frequently Asked Questions

What is the IUPAC name of [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine?
The IUPAC name of [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine (CID 105314544) is [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine is NNC(C1CC1)C1CSc2ccccc21.
What is the InChIKey of [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine?
The InChIKey is ILJBOKTUEBJNQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S/c13-14-12(8-5-6-8)10-7-15-11-4-2-1-3-9(10)11/h1-4,8,10,12,14H,5-7,13H2.
What are the key properties of [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine?
[cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine has a molecular weight of 220.34 g/mol, XLogP of 2.12, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclopropyl(2,3-dihydro-1-benzothiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 105314544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).