(2S)-N-methoxy-N-methyl-2-phenoxypropanamide

C11H15NO3 — CID 95297395

IUPAC(2S)-N-methoxy-N-methyl-2-phenoxypropanamide
SMILESCON(C)C(=O)[C@H](C)Oc1ccccc1
InChIInChI=1S/C11H15NO3/c1-9(11(13)12(2)14-3)15-10-7-5-4-6-8-10/h4-9H,1-3H3/t9-/m0/s1
InChIKeyWGMUZKSGTSEDOZ-VIFPVBQESA-N
MW209.25 g/mol
LogP1.47
Rot. Bonds4

About (2S)-N-methoxy-N-methyl-2-phenoxypropanamide

(2S)-N-methoxy-N-methyl-2-phenoxypropanamide (PubChem CID 95297395) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is (2S)-N-methoxy-N-methyl-2-phenoxypropanamide.

Molecular Properties

Compound Name(2S)-N-methoxy-N-methyl-2-phenoxypropanamide
PubChem CID95297395
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name(2S)-N-methoxy-N-methyl-2-phenoxypropanamide
SMILESCON(C)C(=O)[C@H](C)Oc1ccccc1
InChIInChI=1S/C11H15NO3/c1-9(11(13)12(2)14-3)15-10-7-5-4-6-8-10/h4-9H,1-3H3/t9-/m0/s1
InChIKeyWGMUZKSGTSEDOZ-VIFPVBQESA-N
XLogP1.47
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-phenoxypropanoic acid;hydrofluoride
CID 161153787
2-phenoxy-N-[2-[N-(2-phenoxypropanoyl)anilino]ethyl]-N-phenylpropanamide
CID 4940214
N-methyl-2-phenoxy-N-(2,2,2-trifluoroethyl)propanamide
CID 78864188
1-N,4-N-bis(2-phenoxypropanoyl)benzene-1,4-dicarbohydrazide
CID 137456577
(2S)-N-ethyl-2-phenoxy-N-phenylpropanamide
CID 670227
N-methyl-2-(4-phenylphenoxy)-N-propan-2-ylpropanamide
CID 78859617
2-(3-methoxyphenoxy)-N-methyl-N-phenylpropanamide
CID 43916072
sodium;hydride;2-phenoxypropanoic acid
CID 174562261
potassium;hydride;2-phenoxypropanoic acid
CID 174805355
methoxycarbonyl 2-phenoxypropanoate
CID 174370299
N-methyl-N-[(2-methylphenyl)methyl]-2-phenoxypropanamide
CID 134028542
2-methylidene-3-phenoxybutanoic acid
CID 21464511

Frequently Asked Questions

What is the IUPAC name of (2S)-N-methoxy-N-methyl-2-phenoxypropanamide?
The IUPAC name of (2S)-N-methoxy-N-methyl-2-phenoxypropanamide (CID 95297395) is (2S)-N-methoxy-N-methyl-2-phenoxypropanamide.
What is the SMILES notation for (2S)-N-methoxy-N-methyl-2-phenoxypropanamide?
The canonical SMILES for (2S)-N-methoxy-N-methyl-2-phenoxypropanamide is CON(C)C(=O)[C@H](C)Oc1ccccc1.
What is the InChIKey of (2S)-N-methoxy-N-methyl-2-phenoxypropanamide?
The InChIKey is WGMUZKSGTSEDOZ-VIFPVBQESA-N. The full InChI is InChI=1S/C11H15NO3/c1-9(11(13)12(2)14-3)15-10-7-5-4-6-8-10/h4-9H,1-3H3/t9-/m0/s1.
What are the key properties of (2S)-N-methoxy-N-methyl-2-phenoxypropanamide?
(2S)-N-methoxy-N-methyl-2-phenoxypropanamide has a molecular weight of 209.25 g/mol, XLogP of 1.47, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-methoxy-N-methyl-2-phenoxypropanamide is sourced from PubChem (CID 95297395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).