(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide

C19H22N2O4 — CID 8873735

IUPAC(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)Oc1cccc(C)c1
InChIInChI=1S/C19H22N2O4/c1-12-6-5-7-16(10-12)25-13(2)19(23)21-17-11-15(20-14(3)22)8-9-18(17)24-4/h5-11,13H,1-4H3,(H,20,22)(H,21,23)/t13-/m1/s1
InChIKeySWMZZVOEKQUVJP-CYBMUJFWSA-N
MW342.40 g/mol
LogP3.37
Rot. Bonds6

About (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide

(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide (PubChem CID 8873735) has the molecular formula C19H22N2O4 and a molecular weight of 342.40 g/mol. Its IUPAC name is (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide
PubChem CID8873735
Molecular FormulaC19H22N2O4
Molecular Weight342.40 g/mol
Exact Mass342.16
IUPAC Name(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide
SMILESCOc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)Oc1cccc(C)c1
InChIInChI=1S/C19H22N2O4/c1-12-6-5-7-16(10-12)25-13(2)19(23)21-17-11-15(20-14(3)22)8-9-18(17)24-4/h5-11,13H,1-4H3,(H,20,22)(H,21,23)/t13-/m1/s1
InChIKeySWMZZVOEKQUVJP-CYBMUJFWSA-N
XLogP3.37
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.40
LogP ≤ 53.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide (CID 8873735) is (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide is COc1ccc(NC(C)=O)cc1NC(=O)[C@@H](C)Oc1cccc(C)c1.
What is the InChIKey of (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide?
The InChIKey is SWMZZVOEKQUVJP-CYBMUJFWSA-N. The full InChI is InChI=1S/C19H22N2O4/c1-12-6-5-7-16(10-12)25-13(2)19(23)21-17-11-15(20-14(3)22)8-9-18(17)24-4/h5-11,13H,1-4H3,(H,20,22)(H,21,23)/t13-/m1/s1.
What are the key properties of (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide?
(2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide has a molecular weight of 342.40 g/mol, XLogP of 3.37, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(5-acetamido-2-methoxyphenyl)-2-(3-methylphenoxy)propanamide is sourced from PubChem (CID 8873735), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).