5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide

C17H15BrN2O3 — CID 56570434

IUPAC5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide
SMILESCCc1ccc(-c2cc(NC(=O)c3oc(Br)cc3C)on2)cc1
InChIInChI=1S/C17H15BrN2O3/c1-3-11-4-6-12(7-5-11)13-9-15(23-20-13)19-17(21)16-10(2)8-14(18)22-16/h4-9H,3H2,1-2H3,(H,19,21)
InChIKeyKPCMFSFFJWWWDQ-UHFFFAOYSA-N
MW375.22 g/mol
LogP4.82
Rot. Bonds4

About 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide

5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide (PubChem CID 56570434) has the molecular formula C17H15BrN2O3 and a molecular weight of 375.22 g/mol. Its IUPAC name is 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide.

Molecular Properties

Compound Name5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide
PubChem CID56570434
Molecular FormulaC17H15BrN2O3
Molecular Weight375.22 g/mol
Exact Mass374.03
IUPAC Name5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide
SMILESCCc1ccc(-c2cc(NC(=O)c3oc(Br)cc3C)on2)cc1
InChIInChI=1S/C17H15BrN2O3/c1-3-11-4-6-12(7-5-11)13-9-15(23-20-13)19-17(21)16-10(2)8-14(18)22-16/h4-9H,3H2,1-2H3,(H,19,21)
InChIKeyKPCMFSFFJWWWDQ-UHFFFAOYSA-N
XLogP4.82
TPSA68.27 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.22
LogP ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

3,5-diacetamido-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]benzamide
CID 56544955
N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-4-methyl-2-propan-2-yl-1,3-thiazole-5-carboxamide
CID 56530199
N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-2,5-difluorobenzamide
CID 56569806
4-cyano-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]benzamide
CID 56529985
N-[2-[[3-(4-ethylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-3,4-dimethylbenzamide
CID 56544921
N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-(methoxymethyl)-1-benzofuran-2-carboxamide
CID 56530093
5-bromo-N-[2-[[3-(4-ethylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]thiophene-2-carboxamide
CID 56544732
3-cyano-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]benzamide
CID 56530069
N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-2-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]sulfanylacetamide
CID 56544891
N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 56529971
4-amino-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-nitrobenzamide
CID 56544763
N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-2-oxo-6-thiophen-2-yl-1H-pyridine-3-carboxamide
CID 56569842

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide?
The IUPAC name of 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide (CID 56570434) is 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide.
What is the SMILES notation for 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide?
The canonical SMILES for 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide is CCc1ccc(-c2cc(NC(=O)c3oc(Br)cc3C)on2)cc1.
What is the InChIKey of 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide?
The InChIKey is KPCMFSFFJWWWDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15BrN2O3/c1-3-11-4-6-12(7-5-11)13-9-15(23-20-13)19-17(21)16-10(2)8-14(18)22-16/h4-9H,3H2,1-2H3,(H,19,21).
What are the key properties of 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide?
5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide has a molecular weight of 375.22 g/mol, XLogP of 4.82, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-[3-(4-ethylphenyl)-1,2-oxazol-5-yl]-3-methylfuran-2-carboxamide is sourced from PubChem (CID 56570434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).