2-[2-(4-ethylphenyl)ethylamino]ethanol

C12H19NO — CID 94679941

IUPAC2-[2-(4-ethylphenyl)ethylamino]ethanol
SMILESCCc1ccc(CCNCCO)cc1
InChIInChI=1S/C12H19NO/c1-2-11-3-5-12(6-4-11)7-8-13-9-10-14/h3-6,13-14H,2,7-10H2,1H3
InChIKeyYLBQWWURASEXOW-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.37
Rot. Bonds6

About 2-[2-(4-ethylphenyl)ethylamino]ethanol

2-[2-(4-ethylphenyl)ethylamino]ethanol (PubChem CID 94679941) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is 2-[2-(4-ethylphenyl)ethylamino]ethanol.

Molecular Properties

Compound Name2-[2-(4-ethylphenyl)ethylamino]ethanol
PubChem CID94679941
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC Name2-[2-(4-ethylphenyl)ethylamino]ethanol
SMILESCCc1ccc(CCNCCO)cc1
InChIInChI=1S/C12H19NO/c1-2-11-3-5-12(6-4-11)7-8-13-9-10-14/h3-6,13-14H,2,7-10H2,1H3
InChIKeyYLBQWWURASEXOW-UHFFFAOYSA-N
XLogP1.37
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-ethylphenyl)ethyl]propan-1-amine
CID 62550246
2-(2-pyridin-4-ylethylamino)ethanol
CID 564407
3-[2-(4-ethylphenyl)ethylamino]propane-1,2-diol
CID 115122267
2-[6-(2-phenylethylamino)hexylamino]ethanol
CID 22104030
1-(4-ethylphenyl)-2-(2-hydroxyethylamino)ethanone
CID 82101293
N-[2-(4-propylphenyl)ethyl]propan-1-amine
CID 62801755
1-ethyl-4-[2-[4-[2-[4-[2-[4-[2-[4-[2-(4-ethylphenyl)ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]phenyl]ethyl]benzene
CID 102370536
4-[2-(4-methylphenyl)ethylamino]butan-1-ol
CID 115217735
4-[2-(4-ethylphenyl)ethylamino]-2,2-dimethylbutanoic acid
CID 115221175
4-[2-(4-ethylphenyl)ethylamino]butanenitrile
CID 115231880
2-[2-(4-ethoxy-3-fluorophenyl)ethylamino]ethanol
CID 98014591
N-[(4-ethylphenyl)methyl]-2-phenylethanamine;hydrochloride
CID 17289928

Frequently Asked Questions

What is the IUPAC name of 2-[2-(4-ethylphenyl)ethylamino]ethanol?
The IUPAC name of 2-[2-(4-ethylphenyl)ethylamino]ethanol (CID 94679941) is 2-[2-(4-ethylphenyl)ethylamino]ethanol.
What is the SMILES notation for 2-[2-(4-ethylphenyl)ethylamino]ethanol?
The canonical SMILES for 2-[2-(4-ethylphenyl)ethylamino]ethanol is CCc1ccc(CCNCCO)cc1.
What is the InChIKey of 2-[2-(4-ethylphenyl)ethylamino]ethanol?
The InChIKey is YLBQWWURASEXOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-2-11-3-5-12(6-4-11)7-8-13-9-10-14/h3-6,13-14H,2,7-10H2,1H3.
What are the key properties of 2-[2-(4-ethylphenyl)ethylamino]ethanol?
2-[2-(4-ethylphenyl)ethylamino]ethanol has a molecular weight of 193.29 g/mol, XLogP of 1.37, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(4-ethylphenyl)ethylamino]ethanol is sourced from PubChem (CID 94679941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).