1-phenyl-2-(1-phenylethylamino)ethanol

C16H19NO — CID 4665183

IUPAC1-phenyl-2-(1-phenylethylamino)ethanol
SMILESCC(NCC(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19NO/c1-13(14-8-4-2-5-9-14)17-12-16(18)15-10-6-3-7-11-15/h2-11,13,16-18H,12H2,1H3
InChIKeyVKWJLDQFNZKCCM-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.07
Rot. Bonds5

About 1-phenyl-2-(1-phenylethylamino)ethanol

1-phenyl-2-(1-phenylethylamino)ethanol (PubChem CID 4665183) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 1-phenyl-2-(1-phenylethylamino)ethanol.

Molecular Properties

Compound Name1-phenyl-2-(1-phenylethylamino)ethanol
PubChem CID4665183
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name1-phenyl-2-(1-phenylethylamino)ethanol
SMILESCC(NCC(O)c1ccccc1)c1ccccc1
InChIInChI=1S/C16H19NO/c1-13(14-8-4-2-5-9-14)17-12-16(18)15-10-6-3-7-11-15/h2-11,13,16-18H,12H2,1H3
InChIKeyVKWJLDQFNZKCCM-UHFFFAOYSA-N
XLogP3.07
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(1S)-1-phenyl-2-(1-phenylethylamino)ethanol
CID 70464051
1-phenyl-2-[1-(4-propan-2-ylphenyl)ethylamino]ethanol
CID 43388825
1-(4-chlorophenyl)-2-[[(1R)-1-phenylethyl]amino]ethanol
CID 78953095
(1S)-1-phenyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]ethanol
CID 93032010
(1S)-1-(4-fluorophenyl)-2-[[(1S)-1-phenylethyl]amino]ethanol
CID 15983832
1-(4-methoxyphenyl)-2-(1-phenylethylamino)ethanol
CID 60766376
1,3-bis[[(1S)-1-phenylethyl]amino]propan-2-ol
CID 15470316
1,4-bis(1-phenylethylamino)butane-2,3-diol
CID 20833353
1-(4-methylsulfonylphenyl)-2-(1-phenylethylamino)ethanol
CID 110896898
1-phenyl-2-(1-pyridin-3-ylethylamino)ethanol
CID 43499221
1-(3-bromophenyl)-2-[[(1S)-1-phenylethyl]amino]ethanol
CID 63867516
2-(3-methylbutan-2-ylamino)-1-phenylethanol
CID 12904820

Frequently Asked Questions

What is the IUPAC name of 1-phenyl-2-(1-phenylethylamino)ethanol?
The IUPAC name of 1-phenyl-2-(1-phenylethylamino)ethanol (CID 4665183) is 1-phenyl-2-(1-phenylethylamino)ethanol.
What is the SMILES notation for 1-phenyl-2-(1-phenylethylamino)ethanol?
The canonical SMILES for 1-phenyl-2-(1-phenylethylamino)ethanol is CC(NCC(O)c1ccccc1)c1ccccc1.
What is the InChIKey of 1-phenyl-2-(1-phenylethylamino)ethanol?
The InChIKey is VKWJLDQFNZKCCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-13(14-8-4-2-5-9-14)17-12-16(18)15-10-6-3-7-11-15/h2-11,13,16-18H,12H2,1H3.
What are the key properties of 1-phenyl-2-(1-phenylethylamino)ethanol?
1-phenyl-2-(1-phenylethylamino)ethanol has a molecular weight of 241.33 g/mol, XLogP of 3.07, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-2-(1-phenylethylamino)ethanol is sourced from PubChem (CID 4665183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).