(2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide

C10H13NO3 — CID 92859938

IUPAC(2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide
SMILESCNC(=O)[C@@H](O)c1ccc(OC)cc1
InChIInChI=1S/C10H13NO3/c1-11-10(13)9(12)7-3-5-8(14-2)6-4-7/h3-6,9,12H,1-2H3,(H,11,13)/t9-/m0/s1
InChIKeyXMPNPHOXVSBURG-VIFPVBQESA-N
MW195.22 g/mol
LogP0.47
Rot. Bonds3

About (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide

(2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide (PubChem CID 92859938) has the molecular formula C10H13NO3 and a molecular weight of 195.22 g/mol. Its IUPAC name is (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide.

Molecular Properties

Compound Name(2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide
PubChem CID92859938
Molecular FormulaC10H13NO3
Molecular Weight195.22 g/mol
Exact Mass195.09
IUPAC Name(2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide
SMILESCNC(=O)[C@@H](O)c1ccc(OC)cc1
InChIInChI=1S/C10H13NO3/c1-11-10(13)9(12)7-3-5-8(14-2)6-4-7/h3-6,9,12H,1-2H3,(H,11,13)/t9-/m0/s1
InChIKeyXMPNPHOXVSBURG-VIFPVBQESA-N
XLogP0.47
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.22
LogP ≤ 50.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-methyl-2-(methylamino)acetamide
CID 82470540
(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid
CID 6951708
1-hydroxy-1-(4-methoxyphenyl)propan-2-one
CID 10080999
ethane;2-hydroxy-2-(4-methoxyphenyl)acetic acid
CID 143238154
calcium bis(2-hydroxy-2-(4-methoxyphenyl)acetate)
CID 140565006
3-hydroxy-3-(4-methoxyphenyl)-2-oxopropanoic acid
CID 70435403
propan-2-yl (2S)-2-hydroxy-2-(4-methoxyphenyl)acetate
CID 129353793
methyl (2S,3R)-2,3-dihydroxy-3-(4-methoxyphenyl)propanoate
CID 11042413
(2R)-2-(4-methoxyphenyl)sulfanyl-N-methylpropanamide
CID 30378344
(2R,3S)-2,3-dihydroxy-N-(4-methoxyphenyl)-3-phenylpropanamide
CID 11087415
(2S,3S)-3-(2-aminophenyl)sulfanyl-2-hydroxy-3-(4-methoxyphenyl)-N-methylpropanamide
CID 57223133
2-(4-methoxyphenyl)-N-propan-2-ylpropanamide
CID 154459065

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide?
The IUPAC name of (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide (CID 92859938) is (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide.
What is the SMILES notation for (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide?
The canonical SMILES for (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide is CNC(=O)[C@@H](O)c1ccc(OC)cc1.
What is the InChIKey of (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide?
The InChIKey is XMPNPHOXVSBURG-VIFPVBQESA-N. The full InChI is InChI=1S/C10H13NO3/c1-11-10(13)9(12)7-3-5-8(14-2)6-4-7/h3-6,9,12H,1-2H3,(H,11,13)/t9-/m0/s1.
What are the key properties of (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide?
(2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide has a molecular weight of 195.22 g/mol, XLogP of 0.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxy-2-(4-methoxyphenyl)-N-methylacetamide is sourced from PubChem (CID 92859938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).