N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide

C23H23NO2 — CID 134903315

IUPACN-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide
SMILESC[C@H]([C@@H](O)c1ccccc1)[C@@H](NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23NO2/c1-17(22(25)19-13-7-3-8-14-19)21(18-11-5-2-6-12-18)24-23(26)20-15-9-4-10-16-20/h2-17,21-22,25H,1H3,(H,24,26)/t17-,21+,22+/m0/s1
InChIKeyXDFZBLWMPGYJBG-MTNREXPMSA-N
MW345.44 g/mol
LogP4.53
Rot. Bonds6

About N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide

N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide (PubChem CID 134903315) has the molecular formula C23H23NO2 and a molecular weight of 345.44 g/mol. Its IUPAC name is N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide.

Molecular Properties

Compound NameN-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide
PubChem CID134903315
Molecular FormulaC23H23NO2
Molecular Weight345.44 g/mol
Exact Mass345.17
IUPAC NameN-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide
SMILESC[C@H]([C@@H](O)c1ccccc1)[C@@H](NC(=O)c1ccccc1)c1ccccc1
InChIInChI=1S/C23H23NO2/c1-17(22(25)19-13-7-3-8-14-19)21(18-11-5-2-6-12-18)24-23(26)20-15-9-4-10-16-20/h2-17,21-22,25H,1H3,(H,24,26)/t17-,21+,22+/m0/s1
InChIKeyXDFZBLWMPGYJBG-MTNREXPMSA-N
XLogP4.53
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.44
LogP ≤ 54.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide 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

N-[(1S,2R)-2-hydroxy-1-phenylpropyl]benzamide
CID 6934600
N-(2-hydroxy-3-oxo-1-phenylbutyl)benzamide
CID 71218694
3-benzamido-2-hydroxy-3-phenylpropanoic acid;hydrochloride
CID 175045736
N-[(1R)-2-acetyl-3-oxo-1-phenylbutyl]benzamide
CID 11587624
4-benzoyl-N-(1-hydroxy-1-phenylpropan-2-yl)benzamide
CID 154861680
(2S,3R)-3-benzamido-2-hydroxy-3-phenylpropanethioic S-acid
CID 18660976
N-(2,3-dihydroxy-1-phenylpropyl)benzamide
CID 14650575
N-[(1S,2R)-2-hydroxy-1-phenylbut-3-enyl]benzamide
CID 57161994
4-methyl-N-[(1S)-2-methyl-1-phenylpropyl]benzamide
CID 9050629
N-[(1S)-2-methyl-1-phenylpropyl]-4-phenylbenzamide
CID 6594177
4-chloro-N-[(1S)-2-methyl-1-phenylpropyl]benzamide
CID 9050596
(2S)-2-benzamido-3-phenylbutanoic acid
CID 18652423

Frequently Asked Questions

What is the IUPAC name of N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide?
The IUPAC name of N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide (CID 134903315) is N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide.
What is the SMILES notation for N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide?
The canonical SMILES for N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide is C[C@H]([C@@H](O)c1ccccc1)[C@@H](NC(=O)c1ccccc1)c1ccccc1.
What is the InChIKey of N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide?
The InChIKey is XDFZBLWMPGYJBG-MTNREXPMSA-N. The full InChI is InChI=1S/C23H23NO2/c1-17(22(25)19-13-7-3-8-14-19)21(18-11-5-2-6-12-18)24-23(26)20-15-9-4-10-16-20/h2-17,21-22,25H,1H3,(H,24,26)/t17-,21+,22+/m0/s1.
What are the key properties of N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide?
N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide has a molecular weight of 345.44 g/mol, XLogP of 4.53, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R,2S,3R)-3-hydroxy-2-methyl-1,3-diphenylpropyl]benzamide is sourced from PubChem (CID 134903315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).