8-(4-methoxyphenoxy)octan-1-amine

C15H25NO2 — CID 90318886

IUPAC8-(4-methoxyphenoxy)octan-1-amine
SMILESCOc1ccc(OCCCCCCCCN)cc1
InChIInChI=1S/C15H25NO2/c1-17-14-8-10-15(11-9-14)18-13-7-5-3-2-4-6-12-16/h8-11H,2-7,12-13,16H2,1H3
InChIKeyUDMUHVHZSWYPOV-UHFFFAOYSA-N
MW251.37 g/mol
LogP3.37
Rot. Bonds10

About 8-(4-methoxyphenoxy)octan-1-amine

8-(4-methoxyphenoxy)octan-1-amine (PubChem CID 90318886) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 8-(4-methoxyphenoxy)octan-1-amine.

Molecular Properties

Compound Name8-(4-methoxyphenoxy)octan-1-amine
PubChem CID90318886
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name8-(4-methoxyphenoxy)octan-1-amine
SMILESCOc1ccc(OCCCCCCCCN)cc1
InChIInChI=1S/C15H25NO2/c1-17-14-8-10-15(11-9-14)18-13-7-5-3-2-4-6-12-16/h8-11H,2-7,12-13,16H2,1H3
InChIKeyUDMUHVHZSWYPOV-UHFFFAOYSA-N
XLogP3.37
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N'-[2-(4-methoxyphenoxy)ethyl]hexane-1,6-diamine
CID 83960627
1-methoxy-4-tetradecoxybenzene
CID 91712423
3-[4-(3-aminopropoxy)phenoxy]propan-1-amine
CID 3650737
3-(4-hexoxyphenoxy)propan-1-amine
CID 90318959
1-(20-bromoicosoxy)-4-methoxybenzene
CID 15444591
5-(4-methylsulfanylphenoxy)pentan-1-amine
CID 63649657
ethane;1-methoxy-4-(4-methoxybutoxy)benzene
CID 143283261
5-(4-methoxyphenyl)pentan-1-amine
CID 11507342
5-(4-methoxyphenoxy)-N-methylpentan-1-amine
CID 62458714
10-(4-methoxyphenyl)decan-1-amine
CID 70566558
5-[4-(4-chlorophenoxy)butoxy]pentan-1-amine
CID 82353611
5-[4-(trifluoromethoxy)phenoxy]pentan-1-amine
CID 113497382

Frequently Asked Questions

What is the IUPAC name of 8-(4-methoxyphenoxy)octan-1-amine?
The IUPAC name of 8-(4-methoxyphenoxy)octan-1-amine (CID 90318886) is 8-(4-methoxyphenoxy)octan-1-amine.
What is the SMILES notation for 8-(4-methoxyphenoxy)octan-1-amine?
The canonical SMILES for 8-(4-methoxyphenoxy)octan-1-amine is COc1ccc(OCCCCCCCCN)cc1.
What is the InChIKey of 8-(4-methoxyphenoxy)octan-1-amine?
The InChIKey is UDMUHVHZSWYPOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-17-14-8-10-15(11-9-14)18-13-7-5-3-2-4-6-12-16/h8-11H,2-7,12-13,16H2,1H3.
What are the key properties of 8-(4-methoxyphenoxy)octan-1-amine?
8-(4-methoxyphenoxy)octan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 3.37, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(4-methoxyphenoxy)octan-1-amine is sourced from PubChem (CID 90318886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).