[1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine

C12H22N2OS — CID 105331419

IUPAC[1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine
SMILESCOc1ccsc1C(CCCC(C)C)NN
InChIInChI=1S/C12H22N2OS/c1-9(2)5-4-6-10(14-13)12-11(15-3)7-8-16-12/h7-10,14H,4-6,13H2,1-3H3
InChIKeyOBCWPOHNQZIRCY-UHFFFAOYSA-N
MW242.39 g/mol
LogP3.09
Rot. Bonds7

About [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine

[1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine (PubChem CID 105331419) has the molecular formula C12H22N2OS and a molecular weight of 242.39 g/mol. Its IUPAC name is [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine.

Molecular Properties

Compound Name[1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine
PubChem CID105331419
Molecular FormulaC12H22N2OS
Molecular Weight242.39 g/mol
Exact Mass242.15
IUPAC Name[1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine
SMILESCOc1ccsc1C(CCCC(C)C)NN
InChIInChI=1S/C12H22N2OS/c1-9(2)5-4-6-10(14-13)12-11(15-3)7-8-16-12/h7-10,14H,4-6,13H2,1-3H3
InChIKeyOBCWPOHNQZIRCY-UHFFFAOYSA-N
XLogP3.09
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.39
LogP ≤ 53.09
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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Frequently Asked Questions

What is the IUPAC name of [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine?
The IUPAC name of [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine (CID 105331419) is [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine.
What is the SMILES notation for [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine?
The canonical SMILES for [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine is COc1ccsc1C(CCCC(C)C)NN.
What is the InChIKey of [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine?
The InChIKey is OBCWPOHNQZIRCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2OS/c1-9(2)5-4-6-10(14-13)12-11(15-3)7-8-16-12/h7-10,14H,4-6,13H2,1-3H3.
What are the key properties of [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine?
[1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine has a molecular weight of 242.39 g/mol, XLogP of 3.09, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-methoxythiophen-2-yl)-5-methylhexyl]hydrazine is sourced from PubChem (CID 105331419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).