N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide

C23H20N2O3 — CID 126470225

IUPACN-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1ncoc1-c1ccc2ccccc2c1
InChIInChI=1S/C23H20N2O3/c1-27-20-9-5-4-7-17(20)12-13-24-23(26)21-22(28-15-25-21)19-11-10-16-6-2-3-8-18(16)14-19/h2-11,14-15H,12-13H2,1H3,(H,24,26)
InChIKeyXABNIUAIQYNVNU-UHFFFAOYSA-N
MW372.42 g/mol
LogP4.48
Rot. Bonds6

About N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide

N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide (PubChem CID 126470225) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide
PubChem CID126470225
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC NameN-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide
SMILESCOc1ccccc1CCNC(=O)c1ncoc1-c1ccc2ccccc2c1
InChIInChI=1S/C23H20N2O3/c1-27-20-9-5-4-7-17(20)12-13-24-23(26)21-22(28-15-25-21)19-11-10-16-6-2-3-8-18(16)14-19/h2-11,14-15H,12-13H2,1H3,(H,24,26)
InChIKeyXABNIUAIQYNVNU-UHFFFAOYSA-N
XLogP4.48
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide?
The IUPAC name of N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide (CID 126470225) is N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide.
What is the SMILES notation for N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide?
The canonical SMILES for N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide is COc1ccccc1CCNC(=O)c1ncoc1-c1ccc2ccccc2c1.
What is the InChIKey of N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide?
The InChIKey is XABNIUAIQYNVNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-27-20-9-5-4-7-17(20)12-13-24-23(26)21-22(28-15-25-21)19-11-10-16-6-2-3-8-18(16)14-19/h2-11,14-15H,12-13H2,1H3,(H,24,26).
What are the key properties of N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide?
N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide has a molecular weight of 372.42 g/mol, XLogP of 4.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyphenyl)ethyl]-5-naphthalen-2-yl-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 126470225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).