(2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide

C19H23NO4 — CID 42093583

IUPAC(2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
SMILESCOc1ccc(O[C@@H](C)C(=O)N(C)Cc2ccccc2OC)cc1
InChIInChI=1S/C19H23NO4/c1-14(24-17-11-9-16(22-3)10-12-17)19(21)20(2)13-15-7-5-6-8-18(15)23-4/h5-12,14H,13H2,1-4H3/t14-/m0/s1
InChIKeyCJLWYAUGYOFIDE-AWEZNQCLSA-N
MW329.40 g/mol
LogP3.13
Rot. Bonds7

About (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide

(2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide (PubChem CID 42093583) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide.

Molecular Properties

Compound Name(2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
PubChem CID42093583
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC Name(2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
SMILESCOc1ccc(O[C@@H](C)C(=O)N(C)Cc2ccccc2OC)cc1
InChIInChI=1S/C19H23NO4/c1-14(24-17-11-9-16(22-3)10-12-17)19(21)20(2)13-15-7-5-6-8-18(15)23-4/h5-12,14H,13H2,1-4H3/t14-/m0/s1
InChIKeyCJLWYAUGYOFIDE-AWEZNQCLSA-N
XLogP3.13
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2-methoxyphenyl)methyl]-N-methyl-2-(4-methylphenoxy)propanamide
CID 43905077
(2R)-2-(2-ethylphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide
CID 92672742
(2R)-N-[(2-methoxyphenyl)methyl]-N-methyl-2-(3-methylphenoxy)propanamide
CID 93486431
(2S)-N-[(2-methoxyphenyl)methyl]-N-methyl-2-(2-propan-2-ylphenoxy)propanamide
CID 99954014
N-[(2-methoxyphenyl)methyl]-N-methyl-2-(2-propan-2-ylphenoxy)propanamide
CID 132761048
(2R)-2-(4-fluorophenoxy)-N-[(4-methoxyphenyl)methyl]-N-methylpropanamide
CID 42560933
N-methyl-N-[(2-methylphenyl)methyl]-2-phenoxypropanamide
CID 134028542
3-(ethylamino)-N-[(2-methoxyphenyl)methyl]-N,2-dimethylpropanamide
CID 62852033
(2S)-2-amino-N-[(2-methoxyphenyl)methyl]-N,4-dimethylpentanamide;hydrochloride
CID 119681273
[1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 2-(4-methoxyphenoxy)propanoate
CID 55517677
(2S)-N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methyl-2-phenoxypropanamide
CID 8874773
(2S)-2-amino-N-[(2-methoxyphenyl)methyl]-N,3,3-trimethylbutanamide
CID 61157066

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
The IUPAC name of (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide (CID 42093583) is (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide.
What is the SMILES notation for (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
The canonical SMILES for (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide is COc1ccc(O[C@@H](C)C(=O)N(C)Cc2ccccc2OC)cc1.
What is the InChIKey of (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
The InChIKey is CJLWYAUGYOFIDE-AWEZNQCLSA-N. The full InChI is InChI=1S/C19H23NO4/c1-14(24-17-11-9-16(22-3)10-12-17)19(21)20(2)13-15-7-5-6-8-18(15)23-4/h5-12,14H,13H2,1-4H3/t14-/m0/s1.
What are the key properties of (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide?
(2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide has a molecular weight of 329.40 g/mol, XLogP of 3.13, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(4-methoxyphenoxy)-N-[(2-methoxyphenyl)methyl]-N-methylpropanamide is sourced from PubChem (CID 42093583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).