N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine

C14H23NO — CID 43190158

IUPACN-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine
SMILESCOCCNC(C)c1c(C)cc(C)cc1C
InChIInChI=1S/C14H23NO/c1-10-8-11(2)14(12(3)9-10)13(4)15-6-7-16-5/h8-9,13,15H,6-7H2,1-5H3
InChIKeyCWOGPSPBNWJRFS-UHFFFAOYSA-N
MW221.34 g/mol
LogP2.91
Rot. Bonds5

About N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine

N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine (PubChem CID 43190158) has the molecular formula C14H23NO and a molecular weight of 221.34 g/mol. Its IUPAC name is N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine
PubChem CID43190158
Molecular FormulaC14H23NO
Molecular Weight221.34 g/mol
Exact Mass221.18
IUPAC NameN-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine
SMILESCOCCNC(C)c1c(C)cc(C)cc1C
InChIInChI=1S/C14H23NO/c1-10-8-11(2)14(12(3)9-10)13(4)15-6-7-16-5/h8-9,13,15H,6-7H2,1-5H3
InChIKeyCWOGPSPBNWJRFS-UHFFFAOYSA-N
XLogP2.91
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.34
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol
CID 82314934
1-(2,4-dimethylphenyl)-N-(2-methoxyethyl)ethanamine
CID 43190157
N-[[1-(2-methoxyethyl)cyclopropyl]methyl]-1-(2,4,6-trimethylphenyl)ethanamine
CID 103903840
2-methyl-N-[1-(2,4,6-trimethylphenyl)ethyl]propan-1-amine
CID 43097444
(1S)-N-(2-methoxyethyl)-1-(4-methylphenyl)ethanamine
CID 26601188
N-methyl-1-(2,4,6-trimethylphenyl)ethanamine
CID 16770838
1-(2-methoxy-3,5-dimethylphenyl)-N-(2-methoxyethyl)propan-2-amine
CID 82262565
4-[1-(2,4,6-trimethylphenyl)ethylamino]butanamide
CID 60865371
N-ethyl-1-(2-methoxy-4,6-dimethylphenyl)ethanamine
CID 106680438
1-(2,5-dimethylthiophen-3-yl)-N-(2-methoxyethyl)ethanamine
CID 43200659
(1R)-N-(2-methoxyethyl)-1-(3-methylthiophen-2-yl)ethanamine
CID 95310705
N-[2-(cyclopenten-1-yl)ethyl]-1-(2,4,6-trimethylphenyl)ethanamine
CID 106169878

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine?
The IUPAC name of N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine (CID 43190158) is N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine.
What is the SMILES notation for N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine?
The canonical SMILES for N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine is COCCNC(C)c1c(C)cc(C)cc1C.
What is the InChIKey of N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine?
The InChIKey is CWOGPSPBNWJRFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO/c1-10-8-11(2)14(12(3)9-10)13(4)15-6-7-16-5/h8-9,13,15H,6-7H2,1-5H3.
What are the key properties of N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine?
N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine has a molecular weight of 221.34 g/mol, XLogP of 2.91, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine is sourced from PubChem (CID 43190158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).