3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide

C15H14N2O3 — CID 9120446

IUPAC3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide
SMILESCc1ccc2oc(C(=O)Nc3cc(C)on3)c(C)c2c1
InChIInChI=1S/C15H14N2O3/c1-8-4-5-12-11(6-8)10(3)14(19-12)15(18)16-13-7-9(2)20-17-13/h4-7H,1-3H3,(H,16,17,18)
InChIKeyHCBYEZZEQIMRQY-UHFFFAOYSA-N
MW270.29 g/mol
LogP3.60
Rot. Bonds2

About 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide

3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide (PubChem CID 9120446) has the molecular formula C15H14N2O3 and a molecular weight of 270.29 g/mol. Its IUPAC name is 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide.

Molecular Properties

Compound Name3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide
PubChem CID9120446
Molecular FormulaC15H14N2O3
Molecular Weight270.29 g/mol
Exact Mass270.10
IUPAC Name3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide
SMILESCc1ccc2oc(C(=O)Nc3cc(C)on3)c(C)c2c1
InChIInChI=1S/C15H14N2O3/c1-8-4-5-12-11(6-8)10(3)14(19-12)15(18)16-13-7-9(2)20-17-13/h4-7H,1-3H3,(H,16,17,18)
InChIKeyHCBYEZZEQIMRQY-UHFFFAOYSA-N
XLogP3.60
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.29
LogP ≤ 53.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-acetylphenyl)-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 7464080
2-fluoro-5-methyl-N-(5-methyl-1,2-oxazol-3-yl)benzamide
CID 62509692
N-cyclopentyl-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 16648842
N-(2-hydroxy-4-methylphenyl)-5-methoxy-3-methyl-1-benzofuran-2-carboxamide
CID 17473856
N-(7-methoxyquinolin-3-yl)-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 95744990
N-[3-(5-iodofuran-2-yl)-1,2,4-thiadiazol-5-yl]-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 26834190
5-bromo-3-methyl-N-pyridin-2-yl-1-benzofuran-2-carboxamide
CID 17461489
(3,5-dimethyl-1-benzofuran-2-yl)-(2,5-dimethylphenyl)methanone
CID 43394206
1-N-(5-methyl-1,2-oxazol-3-yl)-4-N-(2,4,6-trimethylphenyl)benzene-1,4-dicarboxamide
CID 109049837
5-bromo-3-methyl-N-(1-methylpyrazol-3-yl)-1-benzofuran-2-carboxamide
CID 17420094
N-[1-(hydroxymethyl)cyclopent-3-en-1-yl]-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 119058773
N-[1-(cyclopropylmethyl)pyrazol-4-yl]-3,5-dimethyl-1-benzofuran-2-carboxamide
CID 95749289

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide?
The IUPAC name of 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide (CID 9120446) is 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide.
What is the SMILES notation for 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide?
The canonical SMILES for 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide is Cc1ccc2oc(C(=O)Nc3cc(C)on3)c(C)c2c1.
What is the InChIKey of 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide?
The InChIKey is HCBYEZZEQIMRQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O3/c1-8-4-5-12-11(6-8)10(3)14(19-12)15(18)16-13-7-9(2)20-17-13/h4-7H,1-3H3,(H,16,17,18).
What are the key properties of 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide?
3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide has a molecular weight of 270.29 g/mol, XLogP of 3.60, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-N-(5-methyl-1,2-oxazol-3-yl)-1-benzofuran-2-carboxamide is sourced from PubChem (CID 9120446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).