5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide

C21H20N4O3 — CID 35537106

IUPAC5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide
SMILESCc1noc(C)c1Cc1ccc(C(=O)Nc2ccc(-n3ccnc3C)cc2)o1
InChIInChI=1S/C21H20N4O3/c1-13-19(14(2)28-24-13)12-18-8-9-20(27-18)21(26)23-16-4-6-17(7-5-16)25-11-10-22-15(25)3/h4-11H,12H2,1-3H3,(H,23,26)
InChIKeyMFEGSRZTDSGSCQ-UHFFFAOYSA-N
MW376.42 g/mol
LogP4.22
Rot. Bonds5

About 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide

5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide (PubChem CID 35537106) has the molecular formula C21H20N4O3 and a molecular weight of 376.42 g/mol. Its IUPAC name is 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide.

Molecular Properties

Compound Name5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide
PubChem CID35537106
Molecular FormulaC21H20N4O3
Molecular Weight376.42 g/mol
Exact Mass376.15
IUPAC Name5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide
SMILESCc1noc(C)c1Cc1ccc(C(=O)Nc2ccc(-n3ccnc3C)cc2)o1
InChIInChI=1S/C21H20N4O3/c1-13-19(14(2)28-24-13)12-18-8-9-20(27-18)21(26)23-16-4-6-17(7-5-16)25-11-10-22-15(25)3/h4-11H,12H2,1-3H3,(H,23,26)
InChIKeyMFEGSRZTDSGSCQ-UHFFFAOYSA-N
XLogP4.22
TPSA86.09 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.42
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide with MolForge

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Related Compounds

N-[4-(2-methylimidazol-1-yl)phenyl]-5-(pyrrolidin-1-ylmethyl)furan-2-carboxamide
CID 35532104
N-cyclooctyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide
CID 20966695
4-methyl-N-[4-(2-methylimidazol-1-yl)phenyl]-1,2,5-oxadiazole-3-carboxamide
CID 71691428
N-butyl-5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]furan-2-carboxamide
CID 35537550
N-[4-(4,5-dimethylimidazol-1-yl)phenyl]-5-(hydroxymethyl)furan-2-carboxamide
CID 166340595
5-ethyl-N-[4-[(2-methylimidazol-1-yl)methyl]phenyl]furan-2-carboxamide
CID 56784420
5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[3,5-dimethyl-1-[(1,3,5-trimethylpyrazol-4-yl)methyl]pyrazol-4-yl]furan-2-carboxamide
CID 17026424
N-[4-(diethylamino)phenyl]-5-[(2,3,4,5,6-pentamethylphenyl)methyl]furan-2-carboxamide
CID 21047933
5-ethoxy-N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]furan-2-carboxamide
CID 91795041
3-(2-methoxyethyl)-6-methyl-N-[4-(2-methylimidazol-1-yl)phenyl]-4-oxofuro[2,3-d]pyrimidine-5-carboxamide
CID 91949952
N-[[4-(2-methylimidazol-1-yl)phenyl]methyl]acetamide
CID 43907556
2-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]-N-(4-imidazol-1-ylphenyl)benzamide
CID 37182358

Frequently Asked Questions

What is the IUPAC name of 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide?
The IUPAC name of 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide (CID 35537106) is 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide.
What is the SMILES notation for 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide?
The canonical SMILES for 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide is Cc1noc(C)c1Cc1ccc(C(=O)Nc2ccc(-n3ccnc3C)cc2)o1.
What is the InChIKey of 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide?
The InChIKey is MFEGSRZTDSGSCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20N4O3/c1-13-19(14(2)28-24-13)12-18-8-9-20(27-18)21(26)23-16-4-6-17(7-5-16)25-11-10-22-15(25)3/h4-11H,12H2,1-3H3,(H,23,26).
What are the key properties of 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide?
5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide has a molecular weight of 376.42 g/mol, XLogP of 4.22, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-N-[4-(2-methylimidazol-1-yl)phenyl]furan-2-carboxamide is sourced from PubChem (CID 35537106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).