5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide

C22H19N3O3 — CID 16675701

IUPAC5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide
SMILESCOc1ccccc1-c1ocnc1C(=O)Nc1cc(-n2cccc2)ccc1C
InChIInChI=1S/C22H19N3O3/c1-15-9-10-16(25-11-5-6-12-25)13-18(15)24-22(26)20-21(28-14-23-20)17-7-3-4-8-19(17)27-2/h3-14H,1-2H3,(H,24,26)
InChIKeyNGZYYVUMGBVONU-UHFFFAOYSA-N
MW373.41 g/mol
LogP4.70
Rot. Bonds5

About 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide

5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide (PubChem CID 16675701) has the molecular formula C22H19N3O3 and a molecular weight of 373.41 g/mol. Its IUPAC name is 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide.

Molecular Properties

Compound Name5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide
PubChem CID16675701
Molecular FormulaC22H19N3O3
Molecular Weight373.41 g/mol
Exact Mass373.14
IUPAC Name5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide
SMILESCOc1ccccc1-c1ocnc1C(=O)Nc1cc(-n2cccc2)ccc1C
InChIInChI=1S/C22H19N3O3/c1-15-9-10-16(25-11-5-6-12-25)13-18(15)24-22(26)20-21(28-14-23-20)17-7-3-4-8-19(17)27-2/h3-14H,1-2H3,(H,24,26)
InChIKeyNGZYYVUMGBVONU-UHFFFAOYSA-N
XLogP4.70
TPSA69.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.41
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-carbamoylphenyl)-5-(2-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 175655098
5-(2-methoxyphenyl)-N-[2-(pyrrolidine-1-carbonyl)phenyl]-1,3-oxazole-4-carboxamide
CID 126468353
5-(3,4-dimethoxyphenyl)-N-(2,5-dimethylphenyl)-1,3-oxazole-4-carboxamide
CID 20963840
5-(4-methoxyphenyl)-N-(2-methylphenyl)-1,3-oxazole-4-carboxamide
CID 20963550
N-(5-bromo-2-methylphenyl)benzamide;N-(2-methyl-5-pyrrol-1-ylphenyl)benzamide
CID 158601564
N-(2-methylphenyl)-5-phenyl-1,3-oxazole-4-carboxamide
CID 110689264
N-(2,5-dimethylphenyl)-5-(5-methylthiophen-2-yl)-1,3-oxazole-4-carboxamide
CID 46347253
5-(3,4-dimethoxyphenyl)-N-(2,6-dimethylphenyl)-1,3-oxazole-4-carboxamide
CID 20963827
5-(2-chlorophenyl)-N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]-1,3-oxazole-4-carboxamide
CID 99811303
N-(2,4-dimethoxyphenyl)-5-(4-methoxyphenyl)-1,3-oxazole-4-carboxamide
CID 20963534
5-(3,4-dimethoxyphenyl)-N-naphthalen-1-yl-1,3-oxazole-4-carboxamide
CID 126471311
N-(2,5-dimethoxyphenyl)-5-(3-methylphenyl)-1,3-oxazole-4-carboxamide
CID 20963718

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide?
The IUPAC name of 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide (CID 16675701) is 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide.
What is the SMILES notation for 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide?
The canonical SMILES for 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide is COc1ccccc1-c1ocnc1C(=O)Nc1cc(-n2cccc2)ccc1C.
What is the InChIKey of 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide?
The InChIKey is NGZYYVUMGBVONU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O3/c1-15-9-10-16(25-11-5-6-12-25)13-18(15)24-22(26)20-21(28-14-23-20)17-7-3-4-8-19(17)27-2/h3-14H,1-2H3,(H,24,26).
What are the key properties of 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide?
5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide has a molecular weight of 373.41 g/mol, XLogP of 4.70, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyphenyl)-N-(2-methyl-5-pyrrol-1-ylphenyl)-1,3-oxazole-4-carboxamide is sourced from PubChem (CID 16675701), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).