[1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine

C16H22N2S — CID 105210240

IUPAC[1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine
SMILESCC1CCCC(C(NN)c2cccc3ccsc23)C1
InChIInChI=1S/C16H22N2S/c1-11-4-2-6-13(10-11)15(18-17)14-7-3-5-12-8-9-19-16(12)14/h3,5,7-9,11,13,15,18H,2,4,6,10,17H2,1H3
InChIKeySJVIYRJRYQXAGM-UHFFFAOYSA-N
MW274.43 g/mol
LogP4.23
Rot. Bonds3

About [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine

[1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine (PubChem CID 105210240) has the molecular formula C16H22N2S and a molecular weight of 274.43 g/mol. Its IUPAC name is [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine.

Molecular Properties

Compound Name[1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine
PubChem CID105210240
Molecular FormulaC16H22N2S
Molecular Weight274.43 g/mol
Exact Mass274.15
IUPAC Name[1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine
SMILESCC1CCCC(C(NN)c2cccc3ccsc23)C1
InChIInChI=1S/C16H22N2S/c1-11-4-2-6-13(10-11)15(18-17)14-7-3-5-12-8-9-19-16(12)14/h3,5,7-9,11,13,15,18H,2,4,6,10,17H2,1H3
InChIKeySJVIYRJRYQXAGM-UHFFFAOYSA-N
XLogP4.23
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 54.23
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

1-benzothiophen-7-yl-(3-methylcyclopentyl)methanamine
CID 81153500
[(2-fluoro-3-methylphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105313617
1-(1-benzothiophen-7-yl)-1-cyclohexyl-N-methylmethanamine
CID 81153893
[(2-bromo-3-methylphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 107986073
[(2-ethoxyphenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105210206
[1-benzothiophen-7-yl(1,4-diazabicyclo[2.2.2]octan-2-yl)methyl]hydrazine
CID 105249896
N-[1-benzothiophen-7-yl(cyclohexyl)methyl]propan-1-amine
CID 81154118
[3,4-dihydro-2H-chromen-8-yl-(3-methylcyclohexyl)methyl]hydrazine
CID 105210441
[(3-bromophenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105197926
3-[hydrazinyl-(3-methylcyclohexyl)methyl]pyridin-4-amine
CID 105210283
[(2,4-difluorophenyl)-(3-methylcyclohexyl)methyl]hydrazine
CID 105210328
N-[1-benzothiophen-7-yl(oxan-3-yl)methyl]ethanamine
CID 81153499

Frequently Asked Questions

What is the IUPAC name of [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine?
The IUPAC name of [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine (CID 105210240) is [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine.
What is the SMILES notation for [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine?
The canonical SMILES for [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine is CC1CCCC(C(NN)c2cccc3ccsc23)C1.
What is the InChIKey of [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine?
The InChIKey is SJVIYRJRYQXAGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2S/c1-11-4-2-6-13(10-11)15(18-17)14-7-3-5-12-8-9-19-16(12)14/h3,5,7-9,11,13,15,18H,2,4,6,10,17H2,1H3.
What are the key properties of [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine?
[1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine has a molecular weight of 274.43 g/mol, XLogP of 4.23, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-benzothiophen-7-yl-(3-methylcyclohexyl)methyl]hydrazine is sourced from PubChem (CID 105210240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).