2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide

C15H15BrN2O2 — CID 91652329

IUPAC2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide
SMILESO=C(NC(CO)Cc1ccccn1)c1ccccc1Br
InChIInChI=1S/C15H15BrN2O2/c16-14-7-2-1-6-13(14)15(20)18-12(10-19)9-11-5-3-4-8-17-11/h1-8,12,19H,9-10H2,(H,18,20)
InChIKeyYRJKYHVIRSTQAS-UHFFFAOYSA-N
MW335.20 g/mol
LogP2.18
Rot. Bonds5

About 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide

2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide (PubChem CID 91652329) has the molecular formula C15H15BrN2O2 and a molecular weight of 335.20 g/mol. Its IUPAC name is 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide.

Molecular Properties

Compound Name2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide
PubChem CID91652329
Molecular FormulaC15H15BrN2O2
Molecular Weight335.20 g/mol
Exact Mass334.03
IUPAC Name2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide
SMILESO=C(NC(CO)Cc1ccccn1)c1ccccc1Br
InChIInChI=1S/C15H15BrN2O2/c16-14-7-2-1-6-13(14)15(20)18-12(10-19)9-11-5-3-4-8-17-11/h1-8,12,19H,9-10H2,(H,18,20)
InChIKeyYRJKYHVIRSTQAS-UHFFFAOYSA-N
XLogP2.18
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.20
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)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

2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-3-(hydroxymethyl)-N-[(2R)-1-hydroxy-3-pyridin-2-ylpropan-2-yl]benzamide
CID 135138289
2-[3-(4-hydroxyphenyl)-1H-pyrazol-5-yl]-N-[(2R)-1-hydroxy-3-pyridin-2-ylpropan-2-yl]benzamide
CID 137293900
4-(dimethylamino)-N-[(2S)-1-hydroxy-3-pyridin-2-ylpropan-2-yl]pyridine-2-carboxamide
CID 99797738
2-[3-(4-fluorophenyl)-1H-pyrazol-5-yl]-N-[(2R)-1-hydroxy-3-pyridin-2-ylpropan-2-yl]-3-(trifluoromethoxy)benzamide
CID 135138442
3-fluoro-2-[2-(4-fluoro-2-hydroxyphenyl)-1,3-thiazol-5-yl]-N-[(2R)-1-hydroxy-3-pyridin-2-ylpropan-2-yl]benzamide
CID 137289369
3-fluoro-2-[3-(4-fluoro-3-formylphenyl)-1H-pyrazol-5-yl]-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide
CID 175135041
2-[4-amino-5-(4-fluorophenyl)-1,3-thiazol-2-yl]-N-[(2R)-1-hydroxy-3-pyridin-2-ylpropan-2-yl]benzamide
CID 142384422
3-bromo-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2-methylbenzamide
CID 102673913
2-[(2-bromobenzoyl)amino]-N-(pyridin-2-ylmethyl)benzamide
CID 26549863
3-cyano-2-[3-(4-fluorophenyl)-2H-pyrrol-5-yl]-N-[(2R)-1-hydroxy-3-pyridin-2-ylpropan-2-yl]benzamide
CID 146894807
N-(1-hydroxy-3-phenylpropan-2-yl)pyridine-2-carboxamide
CID 55169382
4-bromo-N-[2-(hydroxymethyl)-3-pyridin-2-ylpropyl]benzamide
CID 71862079

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide?
The IUPAC name of 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide (CID 91652329) is 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide.
What is the SMILES notation for 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide?
The canonical SMILES for 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide is O=C(NC(CO)Cc1ccccn1)c1ccccc1Br.
What is the InChIKey of 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide?
The InChIKey is YRJKYHVIRSTQAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrN2O2/c16-14-7-2-1-6-13(14)15(20)18-12(10-19)9-11-5-3-4-8-17-11/h1-8,12,19H,9-10H2,(H,18,20).
What are the key properties of 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide?
2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide has a molecular weight of 335.20 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(1-hydroxy-3-pyridin-2-ylpropan-2-yl)benzamide is sourced from PubChem (CID 91652329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).