N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide

C12H17NO3 — CID 83032241

IUPACN-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NC[C@@H](C)O
InChIInChI=1S/C12H17NO3/c1-9-5-3-4-6-11(9)16-8-12(15)13-7-10(2)14/h3-6,10,14H,7-8H2,1-2H3,(H,13,15)/t10-/m1/s1
InChIKeyHRVIMSPEUJNHQT-SNVBAGLBSA-N
MW223.27 g/mol
LogP0.87
Rot. Bonds5

About N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide

N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide (PubChem CID 83032241) has the molecular formula C12H17NO3 and a molecular weight of 223.27 g/mol. Its IUPAC name is N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide
PubChem CID83032241
Molecular FormulaC12H17NO3
Molecular Weight223.27 g/mol
Exact Mass223.12
IUPAC NameN-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide
SMILESCc1ccccc1OCC(=O)NC[C@@H](C)O
InChIInChI=1S/C12H17NO3/c1-9-5-3-4-6-11(9)16-8-12(15)13-7-10(2)14/h3-6,10,14H,7-8H2,1-2H3,(H,13,15)/t10-/m1/s1
InChIKeyHRVIMSPEUJNHQT-SNVBAGLBSA-N
XLogP0.87
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.27
LogP ≤ 50.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,5-dimethylphenoxy)-N-(2-hydroxypropyl)acetamide
CID 43391088
N-[2-methoxy-2-(2-methoxyphenyl)ethyl]-2-(2-methylphenoxy)acetamide
CID 90597971
2-(2-methylphenoxy)-N-[(2R)-2-(4-methylpiperazin-1-yl)propyl]acetamide
CID 95604367
N-[2-(diethylamino)-2-phenylethyl]-2-(2-methylphenoxy)acetamide
CID 18167114
N-[(2S)-3-methylbutan-2-yl]-2-(2-methylphenoxy)acetamide
CID 94223613
N-[2-hydroxy-2-[4-(trifluoromethyl)phenyl]ethyl]-2-(2-methylphenoxy)acetamide
CID 90534701
N-[(3R)-3-hydroxy-3-phenylpropyl]-2-(2-methylphenoxy)acetamide
CID 96568300
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-methylphenoxy)acetamide
CID 19114396
N-[(2S)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(2-methylphenoxy)acetamide
CID 26819035
2-(2-amino-3-methylphenoxy)-N-(2-methylpropyl)acetamide
CID 43438102
N-(2-hydroxy-4-methylpentyl)-2-(2-hydroxyphenoxy)acetamide
CID 103822650
N-[(2R)-2-(dimethylamino)-2-[4-(dimethylamino)phenyl]ethyl]-2-(2-methylphenoxy)acetamide
CID 7496094

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide?
The IUPAC name of N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide (CID 83032241) is N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide.
What is the SMILES notation for N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide?
The canonical SMILES for N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide is Cc1ccccc1OCC(=O)NC[C@@H](C)O.
What is the InChIKey of N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide?
The InChIKey is HRVIMSPEUJNHQT-SNVBAGLBSA-N. The full InChI is InChI=1S/C12H17NO3/c1-9-5-3-4-6-11(9)16-8-12(15)13-7-10(2)14/h3-6,10,14H,7-8H2,1-2H3,(H,13,15)/t10-/m1/s1.
What are the key properties of N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide?
N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide has a molecular weight of 223.27 g/mol, XLogP of 0.87, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxypropyl]-2-(2-methylphenoxy)acetamide is sourced from PubChem (CID 83032241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).