1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine

C36H62N4O2 — CID 126485611

IUPAC1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine
SMILESCOc1ccccc1CCCCCCN(C)NCCCCCCCCNN(C)CCCCCCc1ccccc1OC
InChIInChI=1S/C36H62N4O2/c1-39(31-21-11-7-13-23-33-25-15-17-27-35(33)41-3)37-29-19-9-5-6-10-20-30-38-40(2)32-22-12-8-14-24-34-26-16-18-28-36(34)42-4/h15-18,25-28,37-38H,5-14,19-24,29-32H2,1-4H3
InChIKeyJTGFSOBSNFALOD-UHFFFAOYSA-N
MW582.92 g/mol
LogP7.82
Rot. Bonds27

About 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine

1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine (PubChem CID 126485611) has the molecular formula C36H62N4O2 and a molecular weight of 582.92 g/mol. Its IUPAC name is 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine.

Molecular Properties

Compound Name1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine
PubChem CID126485611
Molecular FormulaC36H62N4O2
Molecular Weight582.92 g/mol
Exact Mass582.49
IUPAC Name1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine
SMILESCOc1ccccc1CCCCCCN(C)NCCCCCCCCNN(C)CCCCCCc1ccccc1OC
InChIInChI=1S/C36H62N4O2/c1-39(31-21-11-7-13-23-33-25-15-17-27-35(33)41-3)37-29-19-9-5-6-10-20-30-38-40(2)32-22-12-8-14-24-34-26-16-18-28-36(34)42-4/h15-18,25-28,37-38H,5-14,19-24,29-32H2,1-4H3
InChIKeyJTGFSOBSNFALOD-UHFFFAOYSA-N
XLogP7.82
TPSA49.00 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds27
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500582.92
LogP ≤ 57.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine?
The IUPAC name of 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine (CID 126485611) is 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine.
What is the SMILES notation for 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine?
The canonical SMILES for 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine is COc1ccccc1CCCCCCN(C)NCCCCCCCCNN(C)CCCCCCc1ccccc1OC.
What is the InChIKey of 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine?
The InChIKey is JTGFSOBSNFALOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H62N4O2/c1-39(31-21-11-7-13-23-33-25-15-17-27-35(33)41-3)37-29-19-9-5-6-10-20-30-38-40(2)32-22-12-8-14-24-34-26-16-18-28-36(34)42-4/h15-18,25-28,37-38H,5-14,19-24,29-32H2,1-4H3.
What are the key properties of 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine?
1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine has a molecular weight of 582.92 g/mol, XLogP of 7.82, 27 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(2-methoxyphenyl)hexyl]-2-[8-[2-[6-(2-methoxyphenyl)hexyl]-2-methylhydrazinyl]octyl]-1-methylhydrazine is sourced from PubChem (CID 126485611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).