2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline

C16H27NO2 — CID 103409479

IUPAC2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline
SMILESCCc1cccc(CC)c1NCCCOCCOC
InChIInChI=1S/C16H27NO2/c1-4-14-8-6-9-15(5-2)16(14)17-10-7-11-19-13-12-18-3/h6,8-9,17H,4-5,7,10-13H2,1-3H3
InChIKeyWXFQYCNVXGNMLG-UHFFFAOYSA-N
MW265.40 g/mol
LogP3.28
Rot. Bonds10

About 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline

2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline (PubChem CID 103409479) has the molecular formula C16H27NO2 and a molecular weight of 265.40 g/mol. Its IUPAC name is 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline.

Molecular Properties

Compound Name2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline
PubChem CID103409479
Molecular FormulaC16H27NO2
Molecular Weight265.40 g/mol
Exact Mass265.20
IUPAC Name2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline
SMILESCCc1cccc(CC)c1NCCCOCCOC
InChIInChI=1S/C16H27NO2/c1-4-14-8-6-9-15(5-2)16(14)17-10-7-11-19-13-12-18-3/h6,8-9,17H,4-5,7,10-13H2,1-3H3
InChIKeyWXFQYCNVXGNMLG-UHFFFAOYSA-N
XLogP3.28
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.40
LogP ≤ 53.28
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

2,6-diethyl-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]aniline
CID 104562158
3-(2,6-diethylanilino)-N-(2-methoxyethyl)propanamide
CID 109015061
2,6-diethyl-N-octylaniline
CID 63491055
N-[2-(2,6-diethylanilino)ethyl]-N'-(2,6-diethylphenyl)propane-1,3-diamine
CID 18441585
4-(2,6-diethylanilino)butan-1-ol
CID 62327687
3-methoxy-N-[3-(2-methoxyethoxy)propyl]aniline
CID 103409360
methyl 2-[3-(2-methoxyethoxy)propylamino]-3-nitrobenzoate
CID 127266744
N'-(2-ethyl-6-methylphenyl)-N-(2-methoxyethyl)ethane-1,2-diamine
CID 54809654
N-[3-(2-methoxyethoxy)propyl]-2-(trifluoromethyl)aniline
CID 103409295
N-(2,6-diethylphenyl)-2-(3-methoxypropylamino)pyridine-4-carboxamide
CID 109167233
2,6-difluoro-N-(3-methoxypropyl)aniline
CID 60926433
2-bromo-6-[3-(2-methoxyethoxy)propylamino]benzoic acid
CID 114098773

Frequently Asked Questions

What is the IUPAC name of 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline?
The IUPAC name of 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline (CID 103409479) is 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline.
What is the SMILES notation for 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline?
The canonical SMILES for 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline is CCc1cccc(CC)c1NCCCOCCOC.
What is the InChIKey of 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline?
The InChIKey is WXFQYCNVXGNMLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27NO2/c1-4-14-8-6-9-15(5-2)16(14)17-10-7-11-19-13-12-18-3/h6,8-9,17H,4-5,7,10-13H2,1-3H3.
What are the key properties of 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline?
2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline has a molecular weight of 265.40 g/mol, XLogP of 3.28, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-diethyl-N-[3-(2-methoxyethoxy)propyl]aniline is sourced from PubChem (CID 103409479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).