1-(1-benzothiophen-2-yl)propan-2-ylhydrazine

C11H14N2S — CID 119083055

IUPAC1-(1-benzothiophen-2-yl)propan-2-ylhydrazine
SMILESCC(Cc1cc2ccccc2s1)NN
InChIInChI=1S/C11H14N2S/c1-8(13-12)6-10-7-9-4-2-3-5-11(9)14-10/h2-5,7-8,13H,6,12H2,1H3
InChIKeyVURAGAXIRBWWBX-UHFFFAOYSA-N
MW206.31 g/mol
LogP2.30
Rot. Bonds3

About 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine

1-(1-benzothiophen-2-yl)propan-2-ylhydrazine (PubChem CID 119083055) has the molecular formula C11H14N2S and a molecular weight of 206.31 g/mol. Its IUPAC name is 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine.

Molecular Properties

Compound Name1-(1-benzothiophen-2-yl)propan-2-ylhydrazine
PubChem CID119083055
Molecular FormulaC11H14N2S
Molecular Weight206.31 g/mol
Exact Mass206.09
IUPAC Name1-(1-benzothiophen-2-yl)propan-2-ylhydrazine
SMILESCC(Cc1cc2ccccc2s1)NN
InChIInChI=1S/C11H14N2S/c1-8(13-12)6-10-7-9-4-2-3-5-11(9)14-10/h2-5,7-8,13H,6,12H2,1H3
InChIKeyVURAGAXIRBWWBX-UHFFFAOYSA-N
XLogP2.30
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.31
LogP ≤ 52.30
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-(1-benzothiophen-2-yl)-N-methylpropan-2-amine
CID 117194308
3-(1-benzothiophen-2-yl)-2-methylpropanoic acid
CID 117119996
1-benzothiophen-2-ylmethanamine;hydroiodide
CID 175928794
(3S)-3-amino-4-(1-benzothiophen-2-yl)butanoic acid
CID 24820282
2-(fluoromethyl)-1-benzothiophene
CID 119085404
N-[(2S)-1-(1-benzothiophen-2-yl)-3-oxopropan-2-yl]acetamide
CID 22858851
(2S)-2-(1-benzothiophen-2-ylmethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxopropanoic acid
CID 91666105
2-butyl-1-benzothiophene
CID 70061043
(2R)-2-azaniumyl-3-(1-benzothiophen-2-yl)propanoate
CID 29413738
propan-2-yl 3-(1-benzothiophen-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
CID 77397308
1-benzothiophen-2-ylmethyl N-methylcarbamate
CID 23548760
1-(7-chloro-1-benzothiophen-2-yl)-N-methylpropan-2-amine
CID 117196819

Frequently Asked Questions

What is the IUPAC name of 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine?
The IUPAC name of 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine (CID 119083055) is 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine.
What is the SMILES notation for 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine?
The canonical SMILES for 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine is CC(Cc1cc2ccccc2s1)NN.
What is the InChIKey of 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine?
The InChIKey is VURAGAXIRBWWBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2S/c1-8(13-12)6-10-7-9-4-2-3-5-11(9)14-10/h2-5,7-8,13H,6,12H2,1H3.
What are the key properties of 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine?
1-(1-benzothiophen-2-yl)propan-2-ylhydrazine has a molecular weight of 206.31 g/mol, XLogP of 2.30, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-benzothiophen-2-yl)propan-2-ylhydrazine is sourced from PubChem (CID 119083055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).