N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine

C15H25NO2 — CID 82353953

IUPACN-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine
SMILESCCNCCOCc1cc(C(C)C)ccc1OC
InChIInChI=1S/C15H25NO2/c1-5-16-8-9-18-11-14-10-13(12(2)3)6-7-15(14)17-4/h6-7,10,12,16H,5,8-9,11H2,1-4H3
InChIKeyMYMDRKDEKPQOQB-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.94
Rot. Bonds8

About N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine

N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine (PubChem CID 82353953) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine.

Molecular Properties

Compound NameN-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine
PubChem CID82353953
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC NameN-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine
SMILESCCNCCOCc1cc(C(C)C)ccc1OC
InChIInChI=1S/C15H25NO2/c1-5-16-8-9-18-11-14-10-13(12(2)3)6-7-15(14)17-4/h6-7,10,12,16H,5,8-9,11H2,1-4H3
InChIKeyMYMDRKDEKPQOQB-UHFFFAOYSA-N
XLogP2.94
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.94
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

1-[(2-methoxy-5-propan-2-ylphenyl)methoxy]butan-2-amine
CID 82353795
ethyl 2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]acetate
CID 130325605
1-[3-(3,3-dimethylbutoxymethyl)-4-methoxyphenyl]-N-methylethanamine
CID 66232006
1-[3-(2-cyclobutylethoxymethyl)-4-methoxyphenyl]-N-ethylethanamine
CID 106201082
[(2-methoxy-5-propan-2-ylphenyl)methylamino]methanethiol
CID 115227896
1-[4-methoxy-3-[(3-methoxy-3-methylbutoxy)methyl]phenyl]-N-methylethanamine
CID 106665328
3-ethoxy-N-[1-[4-methoxy-3-(methoxymethyl)phenyl]ethyl]propan-1-amine
CID 43514919
N-[[4-methoxy-3-(4-methylpentoxymethyl)phenyl]methyl]ethanamine
CID 62017826
N-[2-[(5-bromo-2-methoxyphenyl)methoxy]ethyl]propan-2-amine
CID 62342039
1-[4-methoxy-3-(3-methoxypropoxymethyl)phenyl]ethanamine
CID 54936626
4-[(2-methoxy-5-propan-2-ylphenyl)methoxy]aniline
CID 82354174
2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]-N-methylacetohydrazide
CID 116845331

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine?
The IUPAC name of N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine (CID 82353953) is N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine.
What is the SMILES notation for N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine?
The canonical SMILES for N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine is CCNCCOCc1cc(C(C)C)ccc1OC.
What is the InChIKey of N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine?
The InChIKey is MYMDRKDEKPQOQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-5-16-8-9-18-11-14-10-13(12(2)3)6-7-15(14)17-4/h6-7,10,12,16H,5,8-9,11H2,1-4H3.
What are the key properties of N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine?
N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine has a molecular weight of 251.37 g/mol, XLogP of 2.94, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-[(2-methoxy-5-propan-2-ylphenyl)methoxy]ethanamine is sourced from PubChem (CID 82353953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).