ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide

C32H36N2O4 — CID 90876607

IUPACethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide
SMILESCC.CC.O=C(NC(c1ccccc1)[C@@H](NC(=O)c1ccccc1O)c1ccccc1)c1ccccc1O
InChIInChI=1S/C28H24N2O4.2C2H6/c31-23-17-9-7-15-21(23)27(33)29-25(19-11-3-1-4-12-19)26(20-13-5-2-6-14-20)30-28(34)22-16-8-10-18-24(22)32;2*1-2/h1-18,25-26,31-32H,(H,29,33)(H,30,34);2*1-2H3/t25-,26?;;/m0../s1
InChIKeyUXNLKCOQPOADBU-LANYYJDVSA-N
MW512.65 g/mol
LogP6.79
Rot. Bonds7

About ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide

ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide (PubChem CID 90876607) has the molecular formula C32H36N2O4 and a molecular weight of 512.65 g/mol. Its IUPAC name is ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide.

Molecular Properties

Compound Nameethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide
PubChem CID90876607
Molecular FormulaC32H36N2O4
Molecular Weight512.65 g/mol
Exact Mass512.27
IUPAC Nameethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide
SMILESCC.CC.O=C(NC(c1ccccc1)[C@@H](NC(=O)c1ccccc1O)c1ccccc1)c1ccccc1O
InChIInChI=1S/C28H24N2O4.2C2H6/c31-23-17-9-7-15-21(23)27(33)29-25(19-11-3-1-4-12-19)26(20-13-5-2-6-14-20)30-28(34)22-16-8-10-18-24(22)32;2*1-2/h1-18,25-26,31-32H,(H,29,33)(H,30,34);2*1-2H3/t25-,26?;;/m0../s1
InChIKeyUXNLKCOQPOADBU-LANYYJDVSA-N
XLogP6.79
TPSA98.66 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms38
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500512.65
LogP ≤ 56.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Analyze ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]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-(2-amino-1-phenylethyl)-2-hydroxybenzamide
CID 55242924
N,2-dihydroxybenzamide;ethane
CID 91440405
ethane;2-hydroxy-N-phenylbenzamide
CID 54170056
2-hydroxy-N-(1-oxopropan-2-yl)benzamide
CID 143616084
2-hydroxy-N-(1-pyridin-3-ylethyl)benzamide
CID 43419974
(2S)-2-[(2-hydroxybenzoyl)amino]butanedioic acid
CID 3043783
2-methyl-N-[(1R,2S)-2-[(2-methylbenzoyl)amino]-1,2-dipyridin-4-ylethyl]benzamide
CID 76971075
2-[(2-hydroxybenzoyl)amino]pentanoic acid
CID 43630253
N-(1-bromo-3-phenylpropan-2-yl)-2-hydroxybenzamide
CID 114311235
2-hydroxy-N-[(2S)-2-phenylbutanoyl]benzamide
CID 99908856
2-hydroxy-N-(2-methylpentan-3-yl)benzamide
CID 61465472
N-[(1R)-1-(3-acetamidophenyl)ethyl]-2-hydroxybenzamide
CID 38518872

Frequently Asked Questions

What is the IUPAC name of ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide?
The IUPAC name of ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide (CID 90876607) is ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide.
What is the SMILES notation for ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide?
The canonical SMILES for ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide is CC.CC.O=C(NC(c1ccccc1)[C@@H](NC(=O)c1ccccc1O)c1ccccc1)c1ccccc1O.
What is the InChIKey of ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide?
The InChIKey is UXNLKCOQPOADBU-LANYYJDVSA-N. The full InChI is InChI=1S/C28H24N2O4.2C2H6/c31-23-17-9-7-15-21(23)27(33)29-25(19-11-3-1-4-12-19)26(20-13-5-2-6-14-20)30-28(34)22-16-8-10-18-24(22)32;2*1-2/h1-18,25-26,31-32H,(H,29,33)(H,30,34);2*1-2H3/t25-,26?;;/m0../s1.
What are the key properties of ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide?
ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide has a molecular weight of 512.65 g/mol, XLogP of 6.79, 7 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-hydroxy-N-[(2S)-2-[(2-hydroxybenzoyl)amino]-1,2-diphenylethyl]benzamide is sourced from PubChem (CID 90876607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).