(2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide

C21H21NO3 — CID 7652482

IUPAC(2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide
SMILESCOc1ccc2ccc(O[C@H](C)C(=O)Nc3ccc(C)cc3)cc2c1
InChIInChI=1S/C21H21NO3/c1-14-4-8-18(9-5-14)22-21(23)15(2)25-20-11-7-16-6-10-19(24-3)12-17(16)13-20/h4-13,15H,1-3H3,(H,22,23)/t15-/m1/s1
InChIKeyIKNWNDRZPUMERO-OAHLLOKOSA-N
MW335.40 g/mol
LogP4.56
Rot. Bonds5

About (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide

(2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide (PubChem CID 7652482) has the molecular formula C21H21NO3 and a molecular weight of 335.40 g/mol. Its IUPAC name is (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide.

Molecular Properties

Compound Name(2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide
PubChem CID7652482
Molecular FormulaC21H21NO3
Molecular Weight335.40 g/mol
Exact Mass335.15
IUPAC Name(2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide
SMILESCOc1ccc2ccc(O[C@H](C)C(=O)Nc3ccc(C)cc3)cc2c1
InChIInChI=1S/C21H21NO3/c1-14-4-8-18(9-5-14)22-21(23)15(2)25-20-11-7-16-6-10-19(24-3)12-17(16)13-20/h4-13,15H,1-3H3,(H,22,23)/t15-/m1/s1
InChIKeyIKNWNDRZPUMERO-OAHLLOKOSA-N
XLogP4.56
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.40
LogP ≤ 54.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide?
The IUPAC name of (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide (CID 7652482) is (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide.
What is the SMILES notation for (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide?
The canonical SMILES for (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide is COc1ccc2ccc(O[C@H](C)C(=O)Nc3ccc(C)cc3)cc2c1.
What is the InChIKey of (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide?
The InChIKey is IKNWNDRZPUMERO-OAHLLOKOSA-N. The full InChI is InChI=1S/C21H21NO3/c1-14-4-8-18(9-5-14)22-21(23)15(2)25-20-11-7-16-6-10-19(24-3)12-17(16)13-20/h4-13,15H,1-3H3,(H,22,23)/t15-/m1/s1.
What are the key properties of (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide?
(2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide has a molecular weight of 335.40 g/mol, XLogP of 4.56, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(7-methoxynaphthalen-2-yl)oxy-N-(4-methylphenyl)propanamide is sourced from PubChem (CID 7652482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).