2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide

C17H19NO3 — CID 109388663

IUPAC2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide
SMILESCc1ccccc1NC(=O)C(C)Oc1cccc(CO)c1
InChIInChI=1S/C17H19NO3/c1-12-6-3-4-9-16(12)18-17(20)13(2)21-15-8-5-7-14(10-15)11-19/h3-10,13,19H,11H2,1-2H3,(H,18,20)
InChIKeyFAWBJNRTSYEYQY-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.89
Rot. Bonds5

About 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide

2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide (PubChem CID 109388663) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide.

Molecular Properties

Compound Name2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide
PubChem CID109388663
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide
SMILESCc1ccccc1NC(=O)C(C)Oc1cccc(CO)c1
InChIInChI=1S/C17H19NO3/c1-12-6-3-4-9-16(12)18-17(20)13(2)21-15-8-5-7-14(10-15)11-19/h3-10,13,19H,11H2,1-2H3,(H,18,20)
InChIKeyFAWBJNRTSYEYQY-UHFFFAOYSA-N
XLogP2.89
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[3-(hydroxymethyl)phenoxy]-N-naphthalen-1-ylpropanamide
CID 109388816
(2R)-2-(3-methylphenoxy)-N-(2-methylphenyl)propanamide
CID 7028027
N-(2,3-dimethylphenyl)-2-(3-ethylphenoxy)propanamide
CID 53266821
N-(3,4-dimethylphenyl)-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388671
(2R)-2-(3,4-dimethylphenoxy)-N-(2-methylphenyl)propanamide
CID 95077645
2-(4-chloro-3,5-dimethylphenoxy)-N-(2-methylphenyl)propanamide
CID 19191588
N-benzyl-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 109388625
2-(3,5-dichlorophenoxy)-N-(2-methylphenyl)propanamide
CID 112778065
2-(3-methylphenoxy)-N-[2-[2-(3-methylphenoxy)propanoylamino]phenyl]propanamide
CID 4211486
N-(2,6-dimethylphenyl)-2-(3-ethylphenoxy)propanamide
CID 53266830
N-(3-fluorophenyl)-2-[3-(hydroxymethyl)phenoxy]propanamide
CID 110884938
(2R)-2-(4-fluorophenoxy)-N-(2-methylphenyl)propanamide
CID 7946714

Frequently Asked Questions

What is the IUPAC name of 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide?
The IUPAC name of 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide (CID 109388663) is 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide.
What is the SMILES notation for 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide?
The canonical SMILES for 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide is Cc1ccccc1NC(=O)C(C)Oc1cccc(CO)c1.
What is the InChIKey of 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide?
The InChIKey is FAWBJNRTSYEYQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-12-6-3-4-9-16(12)18-17(20)13(2)21-15-8-5-7-14(10-15)11-19/h3-10,13,19H,11H2,1-2H3,(H,18,20).
What are the key properties of 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide?
2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide has a molecular weight of 285.34 g/mol, XLogP of 2.89, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(hydroxymethyl)phenoxy]-N-(2-methylphenyl)propanamide is sourced from PubChem (CID 109388663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).