[(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine

C15H24N2O — CID 105233127

IUPAC[(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)C2CCC(C)C2)cc1
InChIInChI=1S/C15H24N2O/c1-3-18-14-8-6-12(7-9-14)15(17-16)13-5-4-11(2)10-13/h6-9,11,13,15,17H,3-5,10,16H2,1-2H3
InChIKeyWUNMDXDEDNOBDW-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.03
Rot. Bonds5

About [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine

[(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine (PubChem CID 105233127) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine.

Molecular Properties

Compound Name[(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine
PubChem CID105233127
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name[(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine
SMILESCCOc1ccc(C(NN)C2CCC(C)C2)cc1
InChIInChI=1S/C15H24N2O/c1-3-18-14-8-6-12(7-9-14)15(17-16)13-5-4-11(2)10-13/h6-9,11,13,15,17H,3-5,10,16H2,1-2H3
InChIKeyWUNMDXDEDNOBDW-UHFFFAOYSA-N
XLogP3.03
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.03
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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Frequently Asked Questions

What is the IUPAC name of [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine?
The IUPAC name of [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine (CID 105233127) is [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine.
What is the SMILES notation for [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine?
The canonical SMILES for [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine is CCOc1ccc(C(NN)C2CCC(C)C2)cc1.
What is the InChIKey of [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine?
The InChIKey is WUNMDXDEDNOBDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-3-18-14-8-6-12(7-9-14)15(17-16)13-5-4-11(2)10-13/h6-9,11,13,15,17H,3-5,10,16H2,1-2H3.
What are the key properties of [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine?
[(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine has a molecular weight of 248.37 g/mol, XLogP of 3.03, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4-ethoxyphenyl)-(3-methylcyclopentyl)methyl]hydrazine is sourced from PubChem (CID 105233127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).