N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide

C19H23NO4 — CID 24511211

IUPACN-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide
SMILESCOc1ccc(NC(=O)C(C)Oc2cc(C)cc(C)c2)cc1OC
InChIInChI=1S/C19H23NO4/c1-12-8-13(2)10-16(9-12)24-14(3)19(21)20-15-6-7-17(22-4)18(11-15)23-5/h6-11,14H,1-5H3,(H,20,21)
InChIKeyMIVLPRPPUICCMG-UHFFFAOYSA-N
MW329.40 g/mol
LogP3.73
Rot. Bonds6

About N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide

N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide (PubChem CID 24511211) has the molecular formula C19H23NO4 and a molecular weight of 329.40 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide
PubChem CID24511211
Molecular FormulaC19H23NO4
Molecular Weight329.40 g/mol
Exact Mass329.16
IUPAC NameN-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide
SMILESCOc1ccc(NC(=O)C(C)Oc2cc(C)cc(C)c2)cc1OC
InChIInChI=1S/C19H23NO4/c1-12-8-13(2)10-16(9-12)24-14(3)19(21)20-15-6-7-17(22-4)18(11-15)23-5/h6-11,14H,1-5H3,(H,20,21)
InChIKeyMIVLPRPPUICCMG-UHFFFAOYSA-N
XLogP3.73
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(2R)-2-(4-chlorophenoxy)-N-(3,4-dimethoxyphenyl)propanamide
CID 2088418
(2S)-2-(4-chloro-3-methylphenoxy)-N-(3,4-dimethoxyphenyl)propanamide
CID 26802583
(2S)-N-(4-ethoxy-3-methoxyphenyl)-2-(3-methylphenoxy)propanamide
CID 39729674
N-(3,4-dimethoxyphenyl)-2-(3-fluorophenoxy)propanamide
CID 51233943
N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylanilino)propanamide
CID 51242692
(2R)-2-(3,5-dimethylphenoxy)-N-(4-fluorophenyl)propanamide
CID 9173132
(2R)-N-(3-acetamidophenyl)-2-(3,5-dimethylphenoxy)propanamide
CID 29464050
(2R)-2-[4-[(2S)-butan-2-yl]phenoxy]-N-(3,4-dimethoxyphenyl)propanamide
CID 26561785
N-(5-chloro-2-methoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide
CID 17341494
methyl 4-[(2S)-1-(3,4-dimethoxyanilino)-1-oxopropan-2-yl]oxy-3-methoxybenzoate
CID 8729040
(2R)-2-(3,5-dimethylphenoxy)-N-(4-ethylphenyl)propanamide
CID 40746967
(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide
CID 8873735

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide (CID 24511211) is N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide is COc1ccc(NC(=O)C(C)Oc2cc(C)cc(C)c2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide?
The InChIKey is MIVLPRPPUICCMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO4/c1-12-8-13(2)10-16(9-12)24-14(3)19(21)20-15-6-7-17(22-4)18(11-15)23-5/h6-11,14H,1-5H3,(H,20,21).
What are the key properties of N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide?
N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide has a molecular weight of 329.40 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-2-(3,5-dimethylphenoxy)propanamide is sourced from PubChem (CID 24511211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).