[2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine

C17H20N2OS — CID 105291679

IUPAC[2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
SMILESCc1oc(C)c(C(Cc2csc3ccccc23)NN)c1C
InChIInChI=1S/C17H20N2OS/c1-10-11(2)20-12(3)17(10)15(19-18)8-13-9-21-16-7-5-4-6-14(13)16/h4-7,9,15,19H,8,18H2,1-3H3
InChIKeyBGHSULVCABETKE-UHFFFAOYSA-N
MW300.43 g/mol
LogP4.17
Rot. Bonds4

About [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine

[2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine (PubChem CID 105291679) has the molecular formula C17H20N2OS and a molecular weight of 300.43 g/mol. Its IUPAC name is [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
PubChem CID105291679
Molecular FormulaC17H20N2OS
Molecular Weight300.43 g/mol
Exact Mass300.13
IUPAC Name[2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
SMILESCc1oc(C)c(C(Cc2csc3ccccc23)NN)c1C
InChIInChI=1S/C17H20N2OS/c1-10-11(2)20-12(3)17(10)15(19-18)8-13-9-21-16-7-5-4-6-14(13)16/h4-7,9,15,19H,8,18H2,1-3H3
InChIKeyBGHSULVCABETKE-UHFFFAOYSA-N
XLogP4.17
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.43
LogP ≤ 54.17
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

2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethanamine
CID 115823714
[2-(1-benzothiophen-3-yl)-1-(2-fluoro-3-methylphenyl)ethyl]hydrazine
CID 105291760
[2-(1-benzothiophen-3-yl)-1-(4-bromothiophen-2-yl)ethyl]hydrazine
CID 105222485
1-(1-benzothiophen-3-yl)butan-2-ylhydrazine
CID 105201011
[2-(1-benzothiophen-3-yl)-1-(3,4-difluorophenyl)ethyl]hydrazine
CID 105197098
[2-(2,5-dimethylphenyl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine
CID 105287695
2-(1-benzothiophen-3-yl)-N-ethyl-1-(2-methylfuran-3-yl)ethanamine
CID 104790256
[3-(1-benzothiophen-3-yl)-1,1,1-trifluoropropan-2-yl]hydrazine
CID 105215688
3-(1-benzothiophen-3-yl)-2-hydrazinyl-N,N-dimethylpropan-1-amine
CID 105244750
1-(1-benzothiophen-3-yl)-N-methyl-1-(2,4,5-trimethylfuran-3-yl)methanamine
CID 65151844
2-(1-benzothiophen-3-yl)-1-(5-methylfuran-2-yl)ethanol
CID 65150670
[2-(1-benzothiophen-3-yl)-1-(2,2,3,3-tetramethylcyclopropyl)ethyl]hydrazine
CID 105291757

Frequently Asked Questions

What is the IUPAC name of [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine (CID 105291679) is [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine is Cc1oc(C)c(C(Cc2csc3ccccc23)NN)c1C.
What is the InChIKey of [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
The InChIKey is BGHSULVCABETKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2OS/c1-10-11(2)20-12(3)17(10)15(19-18)8-13-9-21-16-7-5-4-6-14(13)16/h4-7,9,15,19H,8,18H2,1-3H3.
What are the key properties of [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine?
[2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine has a molecular weight of 300.43 g/mol, XLogP of 4.17, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1-benzothiophen-3-yl)-1-(2,4,5-trimethylfuran-3-yl)ethyl]hydrazine is sourced from PubChem (CID 105291679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).