[(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine

C16H18N2OS — CID 105338244

IUPAC[(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
SMILESCCc1ccsc1C(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C16H18N2OS/c1-3-11-6-7-20-16(11)15(18-17)14-9-12-8-10(2)4-5-13(12)19-14/h4-9,15,18H,3,17H2,1-2H3
InChIKeyIQMQEAOVKUFCFX-UHFFFAOYSA-N
MW286.40 g/mol
LogP3.92
Rot. Bonds4

About [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine

[(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine (PubChem CID 105338244) has the molecular formula C16H18N2OS and a molecular weight of 286.40 g/mol. Its IUPAC name is [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
PubChem CID105338244
Molecular FormulaC16H18N2OS
Molecular Weight286.40 g/mol
Exact Mass286.11
IUPAC Name[(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
SMILESCCc1ccsc1C(NN)c1cc2cc(C)ccc2o1
InChIInChI=1S/C16H18N2OS/c1-3-11-6-7-20-16(11)15(18-17)14-9-12-8-10(2)4-5-13(12)19-14/h4-9,15,18H,3,17H2,1-2H3
InChIKeyIQMQEAOVKUFCFX-UHFFFAOYSA-N
XLogP3.92
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.40
LogP ≤ 53.92
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

[(3-ethylthiophen-2-yl)-(7-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 105338360
N-[(3-bromothiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]propan-1-amine
CID 105045202
N-[1-benzofuran-2-yl-(3-ethylthiophen-2-yl)methyl]propan-1-amine
CID 105044087
(5-methyl-1-benzofuran-2-yl)-(3-methylthiophen-2-yl)methanamine
CID 63993046
[(5-methyl-1-benzofuran-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313231
N-[(5-methyl-1-benzofuran-2-yl)-(2-methylthiophen-3-yl)methyl]ethanamine
CID 102841419
(3-chlorothiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methanamine
CID 105045316
[(3-ethylthiophen-2-yl)-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313192
[1-(5-methyl-1-benzofuran-2-yl)-2-(4-methyl-1,3-thiazol-2-yl)ethyl]hydrazine
CID 105214131
1-(5-methyl-1-benzofuran-2-yl)propan-1-amine
CID 65440376
[(2-ethyl-1,2,4-triazol-3-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine
CID 112744358
[2-ethyl-1-(5-methyl-1-benzofuran-2-yl)butyl]hydrazine
CID 105324027

Frequently Asked Questions

What is the IUPAC name of [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
The IUPAC name of [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine (CID 105338244) is [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine.
What is the SMILES notation for [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
The canonical SMILES for [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine is CCc1ccsc1C(NN)c1cc2cc(C)ccc2o1.
What is the InChIKey of [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
The InChIKey is IQMQEAOVKUFCFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2OS/c1-3-11-6-7-20-16(11)15(18-17)14-9-12-8-10(2)4-5-13(12)19-14/h4-9,15,18H,3,17H2,1-2H3.
What are the key properties of [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine?
[(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine has a molecular weight of 286.40 g/mol, XLogP of 3.92, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-ethylthiophen-2-yl)-(5-methyl-1-benzofuran-2-yl)methyl]hydrazine is sourced from PubChem (CID 105338244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).