(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide

C17H19NO3 — CID 95788721

IUPAC(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)Nc2cccc(C)c2O)c1
InChIInChI=1S/C17H19NO3/c1-11-6-4-8-14(10-11)21-13(3)17(20)18-15-9-5-7-12(2)16(15)19/h4-10,13,19H,1-3H3,(H,18,20)/t13-/m1/s1
InChIKeyGUHJQAGEKKOVMV-CYBMUJFWSA-N
MW285.34 g/mol
LogP3.42
Rot. Bonds4

About (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide

(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide (PubChem CID 95788721) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide
PubChem CID95788721
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide
SMILESCc1cccc(O[C@H](C)C(=O)Nc2cccc(C)c2O)c1
InChIInChI=1S/C17H19NO3/c1-11-6-4-8-14(10-11)21-13(3)17(20)18-15-9-5-7-12(2)16(15)19/h4-10,13,19H,1-3H3,(H,18,20)/t13-/m1/s1
InChIKeyGUHJQAGEKKOVMV-CYBMUJFWSA-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

Computed Properties (RDKit)

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

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Related Compounds

(2R)-2-(3-methylphenoxy)-N-(2-methylphenyl)propanamide
CID 7028027
(2R)-N-(2,3-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 2640909
N-(2,3-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 4931110
2-(3-methylphenoxy)-N-[2-[2-(3-methylphenoxy)propanoylamino]phenyl]propanamide
CID 4211486
N-(2-hydroxyphenyl)-2-(3-methylphenoxy)propanamide
CID 18103927
N-(2,4-dimethylphenyl)-2-(3-methylphenoxy)propanamide
CID 4931062
(2R)-2-(3-methylphenoxy)-N-(2-propan-2-ylphenyl)propanamide
CID 841227
(2S)-N-(2-fluorophenyl)-2-(3-methylphenoxy)propanamide
CID 2710252
N-[2-methyl-4-[3-methyl-4-[2-(3-methylphenoxy)propanoylamino]phenyl]phenyl]-2-(3-methylphenoxy)propanamide
CID 4931464
(2S)-N-(4-iodo-2-methylphenyl)-2-(3-methylphenoxy)propanamide
CID 95076832
(2R)-2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 7946484
2-(3-methylphenoxy)-N-(3-methylphenyl)propanamide
CID 4931056

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide (CID 95788721) is (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide is Cc1cccc(O[C@H](C)C(=O)Nc2cccc(C)c2O)c1.
What is the InChIKey of (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide?
The InChIKey is GUHJQAGEKKOVMV-CYBMUJFWSA-N. The full InChI is InChI=1S/C17H19NO3/c1-11-6-4-8-14(10-11)21-13(3)17(20)18-15-9-5-7-12(2)16(15)19/h4-10,13,19H,1-3H3,(H,18,20)/t13-/m1/s1.
What are the key properties of (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide?
(2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)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 (2R)-N-(2-hydroxy-3-methylphenyl)-2-(3-methylphenoxy)propanamide is sourced from PubChem (CID 95788721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).