[6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine

C16H28N2O2 — CID 103026524

IUPAC[6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine
SMILESCOc1ccc(CCC(CCC(C)(C)OC)NN)cc1
InChIInChI=1S/C16H28N2O2/c1-16(2,20-4)12-11-14(18-17)8-5-13-6-9-15(19-3)10-7-13/h6-7,9-10,14,18H,5,8,11-12,17H2,1-4H3
InChIKeySPLPTRBOFOMGPP-UHFFFAOYSA-N
MW280.41 g/mol
LogP2.66
Rot. Bonds9

About [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine

[6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine (PubChem CID 103026524) has the molecular formula C16H28N2O2 and a molecular weight of 280.41 g/mol. Its IUPAC name is [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine.

Molecular Properties

Compound Name[6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine
PubChem CID103026524
Molecular FormulaC16H28N2O2
Molecular Weight280.41 g/mol
Exact Mass280.22
IUPAC Name[6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine
SMILESCOc1ccc(CCC(CCC(C)(C)OC)NN)cc1
InChIInChI=1S/C16H28N2O2/c1-16(2,20-4)12-11-14(18-17)8-5-13-6-9-15(19-3)10-7-13/h6-7,9-10,14,18H,5,8,11-12,17H2,1-4H3
InChIKeySPLPTRBOFOMGPP-UHFFFAOYSA-N
XLogP2.66
TPSA56.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.41
LogP ≤ 52.66
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 [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine?
The IUPAC name of [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine (CID 103026524) is [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine.
What is the SMILES notation for [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine?
The canonical SMILES for [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine is COc1ccc(CCC(CCC(C)(C)OC)NN)cc1.
What is the InChIKey of [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine?
The InChIKey is SPLPTRBOFOMGPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2O2/c1-16(2,20-4)12-11-14(18-17)8-5-13-6-9-15(19-3)10-7-13/h6-7,9-10,14,18H,5,8,11-12,17H2,1-4H3.
What are the key properties of [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine?
[6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine has a molecular weight of 280.41 g/mol, XLogP of 2.66, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-methoxy-1-(4-methoxyphenyl)-6-methylheptan-3-yl]hydrazine is sourced from PubChem (CID 103026524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).