[(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine

C13H22N2OS — CID 102843086

IUPAC[(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCOC1(C(NN)c2ccsc2C)CCCCC1
InChIInChI=1S/C13H22N2OS/c1-10-11(6-9-17-10)12(15-14)13(16-2)7-4-3-5-8-13/h6,9,12,15H,3-5,7-8,14H2,1-2H3
InChIKeyHUBANZZMXRNIOH-UHFFFAOYSA-N
MW254.40 g/mol
LogP2.91
Rot. Bonds4

About [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine

[(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine (PubChem CID 102843086) has the molecular formula C13H22N2OS and a molecular weight of 254.40 g/mol. Its IUPAC name is [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine.

Molecular Properties

Compound Name[(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine
PubChem CID102843086
Molecular FormulaC13H22N2OS
Molecular Weight254.40 g/mol
Exact Mass254.15
IUPAC Name[(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine
SMILESCOC1(C(NN)c2ccsc2C)CCCCC1
InChIInChI=1S/C13H22N2OS/c1-10-11(6-9-17-10)12(15-14)13(16-2)7-4-3-5-8-13/h6,9,12,15H,3-5,7-8,14H2,1-2H3
InChIKeyHUBANZZMXRNIOH-UHFFFAOYSA-N
XLogP2.91
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.40
LogP ≤ 52.91
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-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The IUPAC name of [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine (CID 102843086) is [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine.
What is the SMILES notation for [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The canonical SMILES for [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine is COC1(C(NN)c2ccsc2C)CCCCC1.
What is the InChIKey of [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
The InChIKey is HUBANZZMXRNIOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N2OS/c1-10-11(6-9-17-10)12(15-14)13(16-2)7-4-3-5-8-13/h6,9,12,15H,3-5,7-8,14H2,1-2H3.
What are the key properties of [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine?
[(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine has a molecular weight of 254.40 g/mol, XLogP of 2.91, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(1-methoxycyclohexyl)-(2-methylthiophen-3-yl)methyl]hydrazine is sourced from PubChem (CID 102843086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).