2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol

C15H25NO2 — CID 82314934

IUPAC2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol
SMILESCOCCNC(C)C(O)c1c(C)cc(C)cc1C
InChIInChI=1S/C15H25NO2/c1-10-8-11(2)14(12(3)9-10)15(17)13(4)16-6-7-18-5/h8-9,13,15-17H,6-7H2,1-5H3
InChIKeyZYBAGLGNAYWOBX-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.27
Rot. Bonds6

About 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol

2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol (PubChem CID 82314934) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol
PubChem CID82314934
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol
SMILESCOCCNC(C)C(O)c1c(C)cc(C)cc1C
InChIInChI=1S/C15H25NO2/c1-10-8-11(2)14(12(3)9-10)15(17)13(4)16-6-7-18-5/h8-9,13,15-17H,6-7H2,1-5H3
InChIKeyZYBAGLGNAYWOBX-UHFFFAOYSA-N
XLogP2.27
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(propylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol
CID 82314916
N-(2-methoxyethyl)-1-(2,4,6-trimethylphenyl)ethanamine
CID 43190158
1-(3,4-dichlorophenyl)-2-(2-methoxyethylamino)propan-1-ol
CID 82315777
1-(2,5-difluorophenyl)-2-(2-methoxyethylamino)propan-1-ol
CID 82316157
1-(4-ethylphenyl)-2-(2-methoxyethylamino)propan-1-ol
CID 82312671
1-(2,4-dimethylphenyl)-N-(2-methoxyethyl)ethanamine
CID 43190157
1-(2-methoxy-3,5-dimethylphenyl)-N-(2-methoxyethyl)propan-2-amine
CID 82262565
2-(pyridin-3-ylmethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol
CID 82314932
2-(2-methoxyethylamino)-1-(4-methoxy-3-methylphenyl)-3-methylbutan-1-ol
CID 82313839
N-methyl-3-(2,4,6-trimethylphenyl)butan-1-amine
CID 82077222
methyl 3-amino-4-hydroxy-4-(2,4,6-trimethylphenyl)butanoate
CID 82348930
3-amino-5-methoxy-1-(2,4,6-trimethylphenyl)pentan-1-ol
CID 103967406

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol?
The IUPAC name of 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol (CID 82314934) is 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol.
What is the SMILES notation for 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol?
The canonical SMILES for 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol is COCCNC(C)C(O)c1c(C)cc(C)cc1C.
What is the InChIKey of 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol?
The InChIKey is ZYBAGLGNAYWOBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-10-8-11(2)14(12(3)9-10)15(17)13(4)16-6-7-18-5/h8-9,13,15-17H,6-7H2,1-5H3.
What are the key properties of 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol?
2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol has a molecular weight of 251.37 g/mol, XLogP of 2.27, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-1-(2,4,6-trimethylphenyl)propan-1-ol is sourced from PubChem (CID 82314934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).