2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide

C17H18ClNO2 — CID 95367827

IUPAC2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
SMILESO=C(Cc1ccccc1Cl)NC[C@@H](O)Cc1ccccc1
InChIInChI=1S/C17H18ClNO2/c18-16-9-5-4-8-14(16)11-17(21)19-12-15(20)10-13-6-2-1-3-7-13/h1-9,15,20H,10-12H2,(H,19,21)/t15-/m0/s1
InChIKeyRXUHWDZJPPDAQB-HNNXBMFYSA-N
MW303.79 g/mol
LogP2.60
Rot. Bonds6

About 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide

2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide (PubChem CID 95367827) has the molecular formula C17H18ClNO2 and a molecular weight of 303.79 g/mol. Its IUPAC name is 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
PubChem CID95367827
Molecular FormulaC17H18ClNO2
Molecular Weight303.79 g/mol
Exact Mass303.10
IUPAC Name2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
SMILESO=C(Cc1ccccc1Cl)NC[C@@H](O)Cc1ccccc1
InChIInChI=1S/C17H18ClNO2/c18-16-9-5-4-8-14(16)11-17(21)19-12-15(20)10-13-6-2-1-3-7-13/h1-9,15,20H,10-12H2,(H,19,21)/t15-/m0/s1
InChIKeyRXUHWDZJPPDAQB-HNNXBMFYSA-N
XLogP2.60
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.79
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[(2-chlorophenyl)methoxy]-N-(2-hydroxy-3-phenylpropyl)acetamide
CID 111102696
2-(2-chloro-6-fluorophenyl)-N-[(2R)-2-hydroxy-3-phenylpropyl]acetamide
CID 98622782
2-(2-chloro-4-nitrophenyl)-N-(2-hydroxy-3-phenylpropyl)acetamide
CID 71917431
3-[[2-(2-chlorophenyl)acetyl]amino]-2-hydroxypropanamide
CID 107261274
2-(2-chlorophenyl)-N-(2-hydroxy-3-methylbutyl)acetamide
CID 113258913
N-(3-chloro-2-hydroxypropyl)-2-phenylacetamide
CID 131843314
N-[(2R)-2-hydroxy-3-phenylpropyl]-2-thiophen-2-ylacetamide
CID 95379088
N-(2-bromopropyl)-2-(2-chlorophenyl)acetamide
CID 114308630
2-amino-N-[(2-chlorophenyl)methyl]-3-phenylpropanamide
CID 24706399
N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide
CID 95367778
N-(2-hydroxy-3-phenylpropyl)-2-(3-methoxyphenyl)acetamide
CID 90534339
2-chloro-N-[4-[(2-hydroxy-3-phenylpropyl)carbamoyl]phenyl]benzamide
CID 91343467

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
The IUPAC name of 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide (CID 95367827) is 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
The canonical SMILES for 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide is O=C(Cc1ccccc1Cl)NC[C@@H](O)Cc1ccccc1.
What is the InChIKey of 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
The InChIKey is RXUHWDZJPPDAQB-HNNXBMFYSA-N. The full InChI is InChI=1S/C17H18ClNO2/c18-16-9-5-4-8-14(16)11-17(21)19-12-15(20)10-13-6-2-1-3-7-13/h1-9,15,20H,10-12H2,(H,19,21)/t15-/m0/s1.
What are the key properties of 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide?
2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide has a molecular weight of 303.79 g/mol, XLogP of 2.60, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)-N-[(2S)-2-hydroxy-3-phenylpropyl]acetamide is sourced from PubChem (CID 95367827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).