2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide

C18H21NO3 — CID 17340995

IUPAC2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1NC(=O)C(C)Oc1ccc(C)c(C)c1
InChIInChI=1S/C18H21NO3/c1-12-9-10-15(11-13(12)2)22-14(3)18(20)19-16-7-5-6-8-17(16)21-4/h5-11,14H,1-4H3,(H,19,20)
InChIKeyVNOCDDUIRIMDKE-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.72
Rot. Bonds5

About 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide

2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide (PubChem CID 17340995) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide
PubChem CID17340995
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide
SMILESCOc1ccccc1NC(=O)C(C)Oc1ccc(C)c(C)c1
InChIInChI=1S/C18H21NO3/c1-12-9-10-15(11-13(12)2)22-14(3)18(20)19-16-7-5-6-8-17(16)21-4/h5-11,14H,1-4H3,(H,19,20)
InChIKeyVNOCDDUIRIMDKE-UHFFFAOYSA-N
XLogP3.72
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chloro-3-methylphenoxy)-N-(2-methoxyphenyl)propanamide
CID 53265989
(2R)-2-(3,4-dimethylphenoxy)-N-(2-methylphenyl)propanamide
CID 95077645
(2R)-2-(4-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 925101
(2R)-N-(2,5-dimethoxyphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 890330
(2R)-2-(3,4-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)propanamide
CID 26539879
2-(3,4-dimethylphenoxy)-N-(2-methoxy-5-methylphenyl)propanamide
CID 24511206
2-(3,4-dimethylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 53266174
2-(3-methoxyphenoxy)-N-(2-methoxyphenyl)propanamide
CID 19203871
2-(3,4-dimethylphenoxy)-N-(2-methylsulfanylphenyl)propanamide
CID 53286343
2-(3,4-dimethylphenoxy)-N-[2-(2-methoxyphenoxy)ethyl]propanamide
CID 133211025
(2R)-2-(3,4-dimethylphenoxy)-N-(8-methoxyquinolin-5-yl)propanamide
CID 26823081
(2S)-2-(4-methoxyphenoxy)-N-(2-phenoxyphenyl)propanamide
CID 42093263

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide?
The IUPAC name of 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide (CID 17340995) is 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide.
What is the SMILES notation for 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide?
The canonical SMILES for 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide is COc1ccccc1NC(=O)C(C)Oc1ccc(C)c(C)c1.
What is the InChIKey of 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide?
The InChIKey is VNOCDDUIRIMDKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-12-9-10-15(11-13(12)2)22-14(3)18(20)19-16-7-5-6-8-17(16)21-4/h5-11,14H,1-4H3,(H,19,20).
What are the key properties of 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide?
2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide has a molecular weight of 299.37 g/mol, XLogP of 3.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenoxy)-N-(2-methoxyphenyl)propanamide is sourced from PubChem (CID 17340995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).