N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine

C15H26N2O2 — CID 63696644

IUPACN-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine
SMILESCCOCCN(CC)CCOc1ccccc1CN
InChIInChI=1S/C15H26N2O2/c1-3-17(9-11-18-4-2)10-12-19-15-8-6-5-7-14(15)13-16/h5-8H,3-4,9-13,16H2,1-2H3
InChIKeyAISISAJIPVHRTJ-UHFFFAOYSA-N
MW266.38 g/mol
LogP1.88
Rot. Bonds10

About N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine

N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine (PubChem CID 63696644) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine.

Molecular Properties

Compound NameN-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine
PubChem CID63696644
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine
SMILESCCOCCN(CC)CCOc1ccccc1CN
InChIInChI=1S/C15H26N2O2/c1-3-17(9-11-18-4-2)10-12-19-15-8-6-5-7-14(15)13-16/h5-8H,3-4,9-13,16H2,1-2H3
InChIKeyAISISAJIPVHRTJ-UHFFFAOYSA-N
XLogP1.88
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[2-(aminomethyl)phenoxy]-N,N-diethylethanamine
CID 16787209
2-ethoxy-N-ethyl-N-[2-[2-(methylaminomethyl)phenoxy]ethyl]ethanamine
CID 63691253
2-ethoxy-N-ethyl-N-[2-[2-(ethylaminomethyl)phenoxy]ethyl]ethanamine
CID 63691254
2-[2-(aminomethyl)phenoxy]-N-(2-ethoxyethyl)-N-ethylacetamide
CID 63697693
N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
CID 43588461
2-[3-[2-ethoxyethyl(ethyl)amino]propyl]aniline
CID 107274493
N-[2-[2-(aminomethyl)phenoxy]ethyl]-N-(cyclopropylmethyl)propan-1-amine
CID 43478990
N'-[2-[2-(aminomethyl)phenoxy]ethyl]-N,N,N'-trimethylpropane-1,3-diamine
CID 63695677
2-[2-(aminomethyl)phenoxy]-N,N-diethylacetamide
CID 16771866
2-[2-(aminomethyl)phenoxy]-N-[(2-bromophenyl)methyl]-N-methylethanamine
CID 61416325
2-[2-[2-(aminomethyl)phenoxy]ethyl-methylamino]-N,N-dimethylacetamide
CID 43374698
[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]phenyl]methanamine
CID 104559788

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine?
The IUPAC name of N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine (CID 63696644) is N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine.
What is the SMILES notation for N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine?
The canonical SMILES for N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine is CCOCCN(CC)CCOc1ccccc1CN.
What is the InChIKey of N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine?
The InChIKey is AISISAJIPVHRTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-3-17(9-11-18-4-2)10-12-19-15-8-6-5-7-14(15)13-16/h5-8H,3-4,9-13,16H2,1-2H3.
What are the key properties of N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine?
N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine has a molecular weight of 266.38 g/mol, XLogP of 1.88, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(aminomethyl)phenoxy]ethyl]-2-ethoxy-N-ethylethanamine is sourced from PubChem (CID 63696644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).