1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol

C17H21NO2 — CID 60766376

IUPAC1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol
SMILESCOc1ccc(C(O)CNC(C)c2ccccc2)cc1
InChIInChI=1S/C17H21NO2/c1-13(14-6-4-3-5-7-14)18-12-17(19)15-8-10-16(20-2)11-9-15/h3-11,13,17-19H,12H2,1-2H3
InChIKeyMLBXNCPREMKKNS-UHFFFAOYSA-N
MW271.36 g/mol
LogP3.08
Rot. Bonds6

About 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol

1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol (PubChem CID 60766376) has the molecular formula C17H21NO2 and a molecular weight of 271.36 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol
PubChem CID60766376
Molecular FormulaC17H21NO2
Molecular Weight271.36 g/mol
Exact Mass271.16
IUPAC Name1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol
SMILESCOc1ccc(C(O)CNC(C)c2ccccc2)cc1
InChIInChI=1S/C17H21NO2/c1-13(14-6-4-3-5-7-14)18-12-17(19)15-8-10-16(20-2)11-9-15/h3-11,13,17-19H,12H2,1-2H3
InChIKeyMLBXNCPREMKKNS-UHFFFAOYSA-N
XLogP3.08
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.36
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-methoxyphenyl)-2-[[(1R)-1-(4-methylphenyl)ethyl]amino]ethanol
CID 81347393
1-phenyl-2-(1-phenylethylamino)ethanol
CID 4665183
(1S)-1-phenyl-2-(1-phenylethylamino)ethanol
CID 70464051
2-[[(1R)-1-(4-chlorophenyl)ethyl]amino]-1-(4-methoxyphenyl)ethanol
CID 81356620
1-phenyl-2-[1-(4-propan-2-ylphenyl)ethylamino]ethanol
CID 43388825
1,3-bis[[(1S)-1-(4-methoxyphenyl)ethyl]amino]propan-2-ol
CID 71136549
1-(4-chlorophenyl)-2-[[(1R)-1-phenylethyl]amino]ethanol
CID 78953095
(1S)-1-(4-fluorophenyl)-2-[[(1S)-1-phenylethyl]amino]ethanol
CID 15983832
(2S)-1-(4-methoxyphenoxy)-3-[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 7025078
[4-[(1R)-1-hydroxy-2-(1-phenylethylamino)ethyl]phenyl] benzenesulfonate
CID 87367120
1-(3-methoxyphenyl)-2-[[(1R)-1-(4-methylphenyl)ethyl]amino]ethanol
CID 81347397
2-[1-(4-ethoxyphenyl)ethylamino]-1-(3-methoxyphenyl)ethanol
CID 111382254

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol?
The IUPAC name of 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol (CID 60766376) is 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol.
What is the SMILES notation for 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol?
The canonical SMILES for 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol is COc1ccc(C(O)CNC(C)c2ccccc2)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol?
The InChIKey is MLBXNCPREMKKNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H21NO2/c1-13(14-6-4-3-5-7-14)18-12-17(19)15-8-10-16(20-2)11-9-15/h3-11,13,17-19H,12H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol?
1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol has a molecular weight of 271.36 g/mol, XLogP of 3.08, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol is sourced from PubChem (CID 60766376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).