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

C17H19NO3 — CID 17342123

IUPAC2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2cccc(O)c2)cc1C
InChIInChI=1S/C17H19NO3/c1-11-7-8-16(9-12(11)2)21-13(3)17(20)18-14-5-4-6-15(19)10-14/h4-10,13,19H,1-3H3,(H,18,20)
InChIKeyNNGDTGCDMHHXNB-UHFFFAOYSA-N
MW285.34 g/mol
LogP3.42
Rot. Bonds4

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

2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide (PubChem CID 17342123) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide.

Molecular Properties

Compound Name2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide
PubChem CID17342123
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide
SMILESCc1ccc(OC(C)C(=O)Nc2cccc(O)c2)cc1C
InChIInChI=1S/C17H19NO3/c1-11-7-8-16(9-12(11)2)21-13(3)17(20)18-14-5-4-6-15(19)10-14/h4-10,13,19H,1-3H3,(H,18,20)
InChIKeyNNGDTGCDMHHXNB-UHFFFAOYSA-N
XLogP3.42
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S)-2-(3,4-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 7610576
(2S)-N-(3-bromophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 9172441
N-(3-acetylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 17171686
2-(3,4-dimethylphenoxy)-N-[3-(methoxymethyl)phenyl]propanamide
CID 133211034
(2S)-2-(3,4-dimethylphenoxy)-N-[3-(trifluoromethyl)phenyl]propanamide
CID 890062
2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
CID 53266277
(2S)-N-(3,4-dichlorophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 95077681
(2S)-N-(4-bromo-3-methylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 9173242
N-(3,5-dichlorophenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266186
2-(4-chloro-3,5-dimethylphenoxy)-N-(3-methylphenyl)propanamide
CID 21367472
2-(3,4-dimethylphenoxy)-N-(2-methyl-6-propan-2-ylphenyl)propanamide
CID 53266192
N-(4-tert-butylphenyl)-2-(3,4-dimethylphenoxy)propanamide
CID 53266599

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide?
The IUPAC name of 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide (CID 17342123) is 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide.
What is the SMILES notation for 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide?
The canonical SMILES for 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide is Cc1ccc(OC(C)C(=O)Nc2cccc(O)c2)cc1C.
What is the InChIKey of 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide?
The InChIKey is NNGDTGCDMHHXNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-11-7-8-16(9-12(11)2)21-13(3)17(20)18-14-5-4-6-15(19)10-14/h4-10,13,19H,1-3H3,(H,18,20).
What are the key properties of 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide?
2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide has a molecular weight of 285.34 g/mol, XLogP of 3.42, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylphenoxy)-N-(3-hydroxyphenyl)propanamide is sourced from PubChem (CID 17342123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).