2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide

C16H16ClNO2 — CID 42364147

IUPAC2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
SMILESO=C(N[C@H](CO)Cc1ccccc1)c1ccccc1Cl
InChIInChI=1S/C16H16ClNO2/c17-15-9-5-4-8-14(15)16(20)18-13(11-19)10-12-6-2-1-3-7-12/h1-9,13,19H,10-11H2,(H,18,20)/t13-/m0/s1
InChIKeyNOZUZPKFHLERJF-ZDUSSCGKSA-N
MW289.76 g/mol
LogP2.67
Rot. Bonds5

About 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide

2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide (PubChem CID 42364147) has the molecular formula C16H16ClNO2 and a molecular weight of 289.76 g/mol. Its IUPAC name is 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
PubChem CID42364147
Molecular FormulaC16H16ClNO2
Molecular Weight289.76 g/mol
Exact Mass289.09
IUPAC Name2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
SMILESO=C(N[C@H](CO)Cc1ccccc1)c1ccccc1Cl
InChIInChI=1S/C16H16ClNO2/c17-15-9-5-4-8-14(15)16(20)18-13(11-19)10-12-6-2-1-3-7-12/h1-9,13,19H,10-11H2,(H,18,20)/t13-/m0/s1
InChIKeyNOZUZPKFHLERJF-ZDUSSCGKSA-N
XLogP2.67
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.76
LogP ≤ 52.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-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-dichloro-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]benzamide
CID 107861388
2-amino-3-chloro-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]benzamide
CID 107860587
3-chloro-2-fluoro-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]benzamide
CID 107861450
3-chloro-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]pyridine-4-carboxamide
CID 107861114
4-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]pyridine-3-carboxamide
CID 102673766
N-(1-hydroxy-3-phenylpropan-2-yl)-2-iodobenzamide
CID 6709695
2,3-dihydroxy-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
CID 102673829
2-benzoyl-N-(1-hydroxy-3-phenylpropan-2-yl)benzamide
CID 21190791
5-chloro-2-fluoro-N-(1-hydroxy-3-phenylpropan-2-yl)benzamide
CID 63260573
2,5-dichloro-N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]pyridine-4-carboxamide
CID 107860871
4-chloro-2-fluoro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide
CID 102673887
N-[(2R)-1-hydroxy-3-phenylpropan-2-yl]-2-(trifluoromethyl)benzamide
CID 2324672

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide?
The IUPAC name of 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide (CID 42364147) is 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide.
What is the SMILES notation for 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide?
The canonical SMILES for 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide is O=C(N[C@H](CO)Cc1ccccc1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide?
The InChIKey is NOZUZPKFHLERJF-ZDUSSCGKSA-N. The full InChI is InChI=1S/C16H16ClNO2/c17-15-9-5-4-8-14(15)16(20)18-13(11-19)10-12-6-2-1-3-7-12/h1-9,13,19H,10-11H2,(H,18,20)/t13-/m0/s1.
What are the key properties of 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide?
2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide has a molecular weight of 289.76 g/mol, XLogP of 2.67, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[(2S)-1-hydroxy-3-phenylpropan-2-yl]benzamide is sourced from PubChem (CID 42364147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).