(1R)-1-phenyl-2-(2-phenylpropylamino)ethanol

C17H21NO — CID 67763390

IUPAC(1R)-1-phenyl-2-(2-phenylpropylamino)ethanol
SMILESCC(CNC[C@H](O)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-14(15-8-4-2-5-9-15)12-18-13-17(19)16-10-6-3-7-11-16/h2-11,14,17-19H,12-13H2,1H3/t14?,17-/m0/s1
InChIKeyZNJXBGBQZQNBON-JRZJBTRGSA-N
MW255.36 g/mol
LogP3.11
Rot. Bonds6

About (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol

(1R)-1-phenyl-2-(2-phenylpropylamino)ethanol (PubChem CID 67763390) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol.

Molecular Properties

Compound Name(1R)-1-phenyl-2-(2-phenylpropylamino)ethanol
PubChem CID67763390
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name(1R)-1-phenyl-2-(2-phenylpropylamino)ethanol
SMILESCC(CNC[C@H](O)c1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c1-14(15-8-4-2-5-9-15)12-18-13-17(19)16-10-6-3-7-11-16/h2-11,14,17-19H,12-13H2,1H3/t14?,17-/m0/s1
InChIKeyZNJXBGBQZQNBON-JRZJBTRGSA-N
XLogP3.11
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-phenyl-2-(2-phenylpropylamino)ethanol
CID 17158257
1-(4-chlorophenyl)-2-(2-phenylpropylamino)ethanol
CID 115577747
1-(4-fluorophenyl)-2-(2-phenylpropylamino)ethanol
CID 115577350
(1R)-2-[[(2R)-2-hydroxy-2-phenylethyl]amino]-1-phenylethanol
CID 902475
(2R)-2-phenyl-N-[(2S)-2-phenylpropyl]propan-1-amine
CID 7054159
2-(2-methylpropylamino)-1-phenylethanol
CID 3939463
1-(2-phenylpropylamino)propan-2-ol;hydrochloride
CID 17157480
1-(3,4-difluorophenyl)-2-(2-phenylpropylamino)ethanol
CID 115589638
(1S)-2-(ethylamino)-1-phenylethanol
CID 38989247
2-methyl-N-(2-phenylpropyl)propan-1-amine;hydrochloride
CID 17157782
1-[[(2S)-2-hydroxy-2-phenylethyl]amino]propane-2-sulfonic acid
CID 87095458
2-[(2-methoxy-2-phenylethyl)amino]-1-phenylethanol
CID 110176855

Frequently Asked Questions

What is the IUPAC name of (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol?
The IUPAC name of (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol (CID 67763390) is (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol.
What is the SMILES notation for (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol?
The canonical SMILES for (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol is CC(CNC[C@H](O)c1ccccc1)c1ccccc1.
What is the InChIKey of (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol?
The InChIKey is ZNJXBGBQZQNBON-JRZJBTRGSA-N. The full InChI is InChI=1S/C17H21NO/c1-14(15-8-4-2-5-9-15)12-18-13-17(19)16-10-6-3-7-11-16/h2-11,14,17-19H,12-13H2,1H3/t14?,17-/m0/s1.
What are the key properties of (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol?
(1R)-1-phenyl-2-(2-phenylpropylamino)ethanol has a molecular weight of 255.36 g/mol, XLogP of 3.11, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-phenyl-2-(2-phenylpropylamino)ethanol is sourced from PubChem (CID 67763390), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).