N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide

C17H19NO2 — CID 103945384

IUPACN-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)N[C@H](CO)c2ccccc2)c1
InChIInChI=1S/C17H19NO2/c1-13-6-5-7-14(10-13)11-17(20)18-16(12-19)15-8-3-2-4-9-15/h2-10,16,19H,11-12H2,1H3,(H,18,20)/t16-/m1/s1
InChIKeyZQSTUGRIEPOQAX-MRXNPFEDSA-N
MW269.34 g/mol
LogP2.39
Rot. Bonds5

About N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide

N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide (PubChem CID 103945384) has the molecular formula C17H19NO2 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide
PubChem CID103945384
Molecular FormulaC17H19NO2
Molecular Weight269.34 g/mol
Exact Mass269.14
IUPAC NameN-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)N[C@H](CO)c2ccccc2)c1
InChIInChI=1S/C17H19NO2/c1-13-6-5-7-14(10-13)11-17(20)18-16(12-19)15-8-3-2-4-9-15/h2-10,16,19H,11-12H2,1H3,(H,18,20)/t16-/m1/s1
InChIKeyZQSTUGRIEPOQAX-MRXNPFEDSA-N
XLogP2.39
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-hydroxy-1-phenylethyl)-2-[(3-methylphenyl)methylsulfanyl]acetamide
CID 110931174
2-(3-hydroxyphenyl)-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
CID 103946363
2-(3-hydroxyphenyl)-N-[(1S)-2-hydroxy-1-phenylethyl]acetamide
CID 103946380
N-(2-hydroxy-1-phenylethyl)-2-(4-methylphenyl)acetamide
CID 63184520
2-[[2-(3-methylphenyl)acetyl]amino]propanoic acid
CID 62390110
2-[4-(aminomethyl)phenyl]-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
CID 107861946
N-(2-amino-1-phenyl-2-sulfanylideneethyl)-2-(3-methylphenyl)acetamide
CID 62388540
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-(3-methylphenyl)acetamide
CID 79253237
N-[2-hydroxy-1-(3-methylphenyl)ethyl]-2-methylpropanamide
CID 20635114
2-(4-hydroxyphenyl)-N-[(1S)-2-hydroxy-1-phenylethyl]acetamide
CID 103945145
N-(2-chloro-1-phenylethyl)-3-(3-methylphenyl)propanamide
CID 114300070
2-(4-chlorophenyl)-N-[(1R)-2-hydroxy-1-phenylethyl]acetamide
CID 39394106

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide (CID 103945384) is N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide is Cc1cccc(CC(=O)N[C@H](CO)c2ccccc2)c1.
What is the InChIKey of N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide?
The InChIKey is ZQSTUGRIEPOQAX-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H19NO2/c1-13-6-5-7-14(10-13)11-17(20)18-16(12-19)15-8-3-2-4-9-15/h2-10,16,19H,11-12H2,1H3,(H,18,20)/t16-/m1/s1.
What are the key properties of N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide?
N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide has a molecular weight of 269.34 g/mol, XLogP of 2.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-2-hydroxy-1-phenylethyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 103945384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).