N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide

C16H17NO3 — CID 18103927

IUPACN-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(OC(C)C(=O)Nc2ccccc2O)c1
InChIInChI=1S/C16H17NO3/c1-11-6-5-7-13(10-11)20-12(2)16(19)17-14-8-3-4-9-15(14)18/h3-10,12,18H,1-2H3,(H,17,19)
InChIKeyTXRAKCRKZSZAOB-UHFFFAOYSA-N
MW271.32 g/mol
LogP3.11
Rot. Bonds4

About N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide

N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide (PubChem CID 18103927) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide
PubChem CID18103927
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(OC(C)C(=O)Nc2ccccc2O)c1
InChIInChI=1S/C16H17NO3/c1-11-6-5-7-13(10-11)20-12(2)16(19)17-14-8-3-4-9-15(14)18/h3-10,12,18H,1-2H3,(H,17,19)
InChIKeyTXRAKCRKZSZAOB-UHFFFAOYSA-N
XLogP3.11
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 53.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol', 'substructure': 'N/A'}

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Related Compounds

2-(3-methylphenoxy)-N-[2-[2-(3-methylphenoxy)propanoylamino]phenyl]propanamide
CID 4211486
(2R)-2-(3-methylphenoxy)-N-(2-methylphenyl)propanamide
CID 7028027
(2R)-2-(3-methylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 841227
(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide
CID 95788721
(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide
CID 2710252
(2R)-N-(2,3-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 2640909
N-(2,3-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 4931110
N-(2,4-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 4931062
N-(2-cyanophenyl)-2-(3-methylphenoxy)propanamide
CID 2989906
(2R)-2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 7946484
2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 4931056
N-[2-methyl-4-[3-methyl-4-[2-(3-methylphenoxy)propanoylamino]phenyl]phenyl]-2-(3-methylphenoxy)propanamide
CID 4931464

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide?
The IUPAC name of N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide (CID 18103927) is N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide.
What is the SMILES notation for N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide?
The canonical SMILES for N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide is Cc1cccc(OC(C)C(=O)Nc2ccccc2O)c1.
What is the InChIKey of N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide?
The InChIKey is TXRAKCRKZSZAOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-11-6-5-7-13(10-11)20-12(2)16(19)17-14-8-3-4-9-15(14)18/h3-10,12,18H,1-2H3,(H,17,19).
What are the key properties of N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide?
N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide has a molecular weight of 271.32 g/mol, XLogP of 3.11, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide is sourced from PubChem (CID 18103927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).