(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol

C17H21NO — CID 94271411

IUPAC(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol
SMILESO[C@H](CCNCCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c19-17(16-9-5-2-6-10-16)12-14-18-13-11-15-7-3-1-4-8-15/h1-10,17-19H,11-14H2/t17-/m1/s1
InChIKeyAEUMDZRFDUBLRW-QGZVFWFLSA-N
MW255.36 g/mol
LogP2.94
Rot. Bonds7

About (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol

(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol (PubChem CID 94271411) has the molecular formula C17H21NO and a molecular weight of 255.36 g/mol. Its IUPAC name is (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol.

Molecular Properties

Compound Name(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol
PubChem CID94271411
Molecular FormulaC17H21NO
Molecular Weight255.36 g/mol
Exact Mass255.16
IUPAC Name(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol
SMILESO[C@H](CCNCCc1ccccc1)c1ccccc1
InChIInChI=1S/C17H21NO/c19-17(16-9-5-2-6-10-16)12-14-18-13-11-15-7-3-1-4-8-15/h1-10,17-19H,11-14H2/t17-/m1/s1
InChIKeyAEUMDZRFDUBLRW-QGZVFWFLSA-N
XLogP2.94
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.36
LogP ≤ 52.94
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

4-[2-[(3-hydroxy-3-phenylpropyl)amino]ethyl]benzene-1,2-diol
CID 23326154
(1R)-1,3-diphenylpropan-1-ol
CID 11845542
1-(4-methylphenyl)-2-(2-phenylethylamino)ethanol
CID 112501683
4-phenyl-N-(2-phenylethyl)pentan-1-amine
CID 57323485
2-[2-[(2-hydroxy-2-phenylethyl)amino]ethyl]-5-phenylpentanoic acid
CID 67789654
3-amino-1-[3-(2-phenylethylamino)phenyl]propan-1-ol
CID 59316981
1-(3-hydroxy-3-phenylpropyl)-3-[2-(4-methylphenyl)ethyl]urea
CID 111506398
4-(3-hydroxy-3-phenylpropyl)phenol
CID 54456955
(1R)-3-(benzylamino)-1-(4-methoxyphenyl)propan-1-ol
CID 94281330
2-(2-phenylethylamino)-1-pyridin-3-ylethanol
CID 20826867
N-(2-benzhydrylsulfanylethyl)-2-phenylethanamine
CID 10089066
1-[[[(3R)-3-hydroxy-3-phenylpropyl]amino]methyl]cyclobutan-1-ol
CID 112742137

Frequently Asked Questions

What is the IUPAC name of (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol?
The IUPAC name of (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol (CID 94271411) is (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol.
What is the SMILES notation for (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol?
The canonical SMILES for (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol is O[C@H](CCNCCc1ccccc1)c1ccccc1.
What is the InChIKey of (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol?
The InChIKey is AEUMDZRFDUBLRW-QGZVFWFLSA-N. The full InChI is InChI=1S/C17H21NO/c19-17(16-9-5-2-6-10-16)12-14-18-13-11-15-7-3-1-4-8-15/h1-10,17-19H,11-14H2/t17-/m1/s1.
What are the key properties of (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol?
(1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol has a molecular weight of 255.36 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-phenyl-3-(2-phenylethylamino)propan-1-ol is sourced from PubChem (CID 94271411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).