N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine

C14H23NO2 — CID 43505142

IUPACN-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine
SMILESCCNC(C)c1cc(C)ccc1OCCOC
InChIInChI=1S/C14H23NO2/c1-5-15-12(3)13-10-11(2)6-7-14(13)17-9-8-16-4/h6-7,10,12,15H,5,8-9H2,1-4H3
InChIKeyDTXCONKUYKUDTH-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.69
Rot. Bonds7

About N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine

N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine (PubChem CID 43505142) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine
PubChem CID43505142
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC NameN-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine
SMILESCCNC(C)c1cc(C)ccc1OCCOC
InChIInChI=1S/C14H23NO2/c1-5-15-12(3)13-10-11(2)6-7-14(13)17-9-8-16-4/h6-7,10,12,15H,5,8-9H2,1-4H3
InChIKeyDTXCONKUYKUDTH-UHFFFAOYSA-N
XLogP2.69
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.69
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-butoxy-5-methylphenyl)-N-ethylethanamine
CID 43505150
N-ethyl-1-[5-fluoro-2-(2-methoxyethoxy)phenyl]ethanamine
CID 43285224
N-ethyl-1-(2-hexoxy-5-methylphenyl)ethanamine
CID 43505152
N-ethyl-1-[2-[2-(3-methoxypropoxy)ethoxy]-4-methylphenyl]ethanamine
CID 103177842
2-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]acetonitrile
CID 60887297
N-[1-[2-(2-methoxyethoxy)-4-methylphenyl]ethyl]propan-1-amine
CID 55246297
N-cyclopropyl-3-[2-[1-(ethylamino)ethyl]-4-methylphenoxy]propanamide
CID 62628087
1-[2-(2-ethoxyethoxy)-4-methylphenyl]-N-ethylethanamine
CID 63640644
1-[2-(difluoromethoxy)-5-methylphenyl]-N-ethylethanamine
CID 43505197
1-[4-bromo-2-(2-methoxyethoxy)phenyl]-N-ethylethanamine
CID 82976363
1-[2-(cyclopentylmethoxy)-5-methylphenyl]-N-ethylethanamine
CID 61344981
1-[2-(2,3-dichloroprop-2-enoxy)-5-methylphenyl]-N-ethylethanamine
CID 79167893

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine?
The IUPAC name of N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine (CID 43505142) is N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine.
What is the SMILES notation for N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine?
The canonical SMILES for N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine is CCNC(C)c1cc(C)ccc1OCCOC.
What is the InChIKey of N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine?
The InChIKey is DTXCONKUYKUDTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-5-15-12(3)13-10-11(2)6-7-14(13)17-9-8-16-4/h6-7,10,12,15H,5,8-9H2,1-4H3.
What are the key properties of N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine?
N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine has a molecular weight of 237.34 g/mol, XLogP of 2.69, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1-[2-(2-methoxyethoxy)-5-methylphenyl]ethanamine is sourced from PubChem (CID 43505142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).