2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide

C22H21N3O4 — CID 8841949

IUPAC2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide
SMILESCc1ccc(-c2cc(NC(=O)CN(Cc3ccco3)Cc3ccco3)on2)cc1
InChIInChI=1S/C22H21N3O4/c1-16-6-8-17(9-7-16)20-12-22(29-24-20)23-21(26)15-25(13-18-4-2-10-27-18)14-19-5-3-11-28-19/h2-12H,13-15H2,1H3,(H,23,26)
InChIKeyURUMGJXKHCRXJV-UHFFFAOYSA-N
MW391.43 g/mol
LogP4.48
Rot. Bonds8

About 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide

2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide (PubChem CID 8841949) has the molecular formula C22H21N3O4 and a molecular weight of 391.43 g/mol. Its IUPAC name is 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide.

Molecular Properties

Compound Name2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide
PubChem CID8841949
Molecular FormulaC22H21N3O4
Molecular Weight391.43 g/mol
Exact Mass391.15
IUPAC Name2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide
SMILESCc1ccc(-c2cc(NC(=O)CN(Cc3ccco3)Cc3ccco3)on2)cc1
InChIInChI=1S/C22H21N3O4/c1-16-6-8-17(9-7-16)20-12-22(29-24-20)23-21(26)15-25(13-18-4-2-10-27-18)14-19-5-3-11-28-19/h2-12H,13-15H2,1H3,(H,23,26)
InChIKeyURUMGJXKHCRXJV-UHFFFAOYSA-N
XLogP4.48
TPSA84.65 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.43
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[bis(furan-2-ylmethyl)amino]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 24626993
furan-2-ylmethyl-[2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]-(thiophen-2-ylmethyl)azanium
CID 8678477
(3S)-1-(furan-2-ylmethyl)-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-5-oxopyrrolidine-3-carboxamide
CID 41200996
2-[bis(furan-2-ylmethyl)amino]-N-(2,5-dimethylpyrazol-3-yl)acetamide
CID 36802685
2-[bis(furan-2-ylmethyl)amino]-N-methylacetamide
CID 27118866
N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]-2-[[(1S)-1-phenylethyl]amino]acetamide
CID 9345947
2-[furan-2-ylmethyl(pyridin-2-ylmethyl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 91833759
2-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide
CID 9346296
2-benzylsulfanyl-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide
CID 7594665
2-[bis(furan-2-ylmethyl)amino]-N-[2,6-di(propan-2-yl)phenyl]acetamide
CID 46614486
N-(3-acetylphenyl)-2-[bis(furan-2-ylmethyl)amino]acetamide
CID 8840674
benzyl-methyl-[2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]amino]-2-oxoethyl]azanium
CID 9346071

Frequently Asked Questions

What is the IUPAC name of 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide?
The IUPAC name of 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide (CID 8841949) is 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide.
What is the SMILES notation for 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide?
The canonical SMILES for 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide is Cc1ccc(-c2cc(NC(=O)CN(Cc3ccco3)Cc3ccco3)on2)cc1.
What is the InChIKey of 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide?
The InChIKey is URUMGJXKHCRXJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21N3O4/c1-16-6-8-17(9-7-16)20-12-22(29-24-20)23-21(26)15-25(13-18-4-2-10-27-18)14-19-5-3-11-28-19/h2-12H,13-15H2,1H3,(H,23,26).
What are the key properties of 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide?
2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide has a molecular weight of 391.43 g/mol, XLogP of 4.48, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(furan-2-ylmethyl)amino]-N-[3-(4-methylphenyl)-1,2-oxazol-5-yl]acetamide is sourced from PubChem (CID 8841949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).