[(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium

C15H19N2O+ — CID 7337949

IUPAC[(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium
SMILES[NH3+]C[C@@H](O)CN(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H18N2O/c16-11-15(18)12-17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,18H,11-12,16H2/p+1/t15-/m1/s1
InChIKeyWUFRQNTUVKVLBK-OAHLLOKOSA-O
MW243.33 g/mol
LogP1.43
Rot. Bonds5

About [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium

[(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium (PubChem CID 7337949) has the molecular formula C15H19N2O+ and a molecular weight of 243.33 g/mol. Its IUPAC name is [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium.

Molecular Properties

Compound Name[(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium
PubChem CID7337949
Molecular FormulaC15H19N2O+
Molecular Weight243.33 g/mol
Exact Mass243.15
IUPAC Name[(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium
SMILES[NH3+]C[C@@H](O)CN(c1ccccc1)c1ccccc1
InChIInChI=1S/C15H18N2O/c16-11-15(18)12-17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,18H,11-12,16H2/p+1/t15-/m1/s1
InChIKeyWUFRQNTUVKVLBK-OAHLLOKOSA-O
XLogP1.43
TPSA51.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.33
LogP ≤ 51.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[(2S)-2-hydroxy-3-(N-phenylanilino)propyl]-methylazanium
CID 7219591
[(2S)-2-hydroxy-3-(N-phenylanilino)propyl]-dimethyl-propan-2-ylazanium
CID 800954
1-(N-phenylanilino)-3-propan-2-yloxypropan-2-ol
CID 53355364
N-(2,2-difluoroethyl)-N-phenylaniline
CID 10399080
2-[2-hydroxy-3-(N-phenylanilino)propyl]guanidine;sulfuric acid
CID 15564364
1-(N-phenylanilino)-3-quinolin-8-yloxypropan-2-ol
CID 3069813
N-phenyl-N-[2-[1-(N-phenylanilino)but-3-en-2-yloxy]but-3-enyl]aniline
CID 57169544
(2R)-1-(N-methylanilino)propan-2-ol
CID 39236034
ethane;4-methyl-N-(2-methylpropyl)-N-phenylaniline
CID 144663906
N-(iodomethyl)-N-phenylaniline
CID 59863595
(2R)-2-benzamido-3-(N-phenylanilino)propanoic acid
CID 66987066
4-[N-[2-(N-(4-hydroxyphenyl)anilino)ethyl]anilino]phenol
CID 58759192

Frequently Asked Questions

What is the IUPAC name of [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium?
The IUPAC name of [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium (CID 7337949) is [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium.
What is the SMILES notation for [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium?
The canonical SMILES for [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium is [NH3+]C[C@@H](O)CN(c1ccccc1)c1ccccc1.
What is the InChIKey of [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium?
The InChIKey is WUFRQNTUVKVLBK-OAHLLOKOSA-O. The full InChI is InChI=1S/C15H18N2O/c16-11-15(18)12-17(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15,18H,11-12,16H2/p+1/t15-/m1/s1.
What are the key properties of [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium?
[(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium has a molecular weight of 243.33 g/mol, XLogP of 1.43, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-2-hydroxy-3-(N-phenylanilino)propyl]azanium is sourced from PubChem (CID 7337949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).