5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide

C20H17NO3 — CID 9291217

IUPAC5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide
SMILESCC(=O)c1ccc(-c2ccc(C(=O)Nc3ccc(C)cc3)o2)cc1
InChIInChI=1S/C20H17NO3/c1-13-3-9-17(10-4-13)21-20(23)19-12-11-18(24-19)16-7-5-15(6-8-16)14(2)22/h3-12H,1-2H3,(H,21,23)
InChIKeyBWQOBLDTAKDRJL-UHFFFAOYSA-N
MW319.36 g/mol
LogP4.71
Rot. Bonds4

About 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide

5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide (PubChem CID 9291217) has the molecular formula C20H17NO3 and a molecular weight of 319.36 g/mol. Its IUPAC name is 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide
PubChem CID9291217
Molecular FormulaC20H17NO3
Molecular Weight319.36 g/mol
Exact Mass319.12
IUPAC Name5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide
SMILESCC(=O)c1ccc(-c2ccc(C(=O)Nc3ccc(C)cc3)o2)cc1
InChIInChI=1S/C20H17NO3/c1-13-3-9-17(10-4-13)21-20(23)19-12-11-18(24-19)16-7-5-15(6-8-16)14(2)22/h3-12H,1-2H3,(H,21,23)
InChIKeyBWQOBLDTAKDRJL-UHFFFAOYSA-N
XLogP4.71
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.36
LogP ≤ 54.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-acetylphenyl)-N-pyridin-4-ylfuran-2-carboxamide
CID 18109203
5-(4-acetylphenyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)furan-2-carboxamide
CID 2557228
4-(5-methylfuran-2-yl)-N-(4-methylphenyl)benzamide
CID 7463717
N,5-bis(4-chlorophenyl)furan-2-carboxamide
CID 781867
5-(4-acetylphenyl)-N-(5-methyl-1,3-thiazol-2-yl)furan-2-carboxamide
CID 18081234
4-[[5-(3-chloro-4-methylphenyl)furan-2-carbonyl]amino]benzoic acid
CID 28914790
N-(4-acetylphenyl)-5-sulfamoylfuran-2-carboxamide
CID 84575705
N-[4-(acetylcarbamothioylamino)phenyl]-5-(4-chlorophenyl)furan-2-carboxamide
CID 5230073
N-(4-chlorophenyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 18871483
methyl 5-[4-[(4-phenylphenyl)carbamoyl]phenyl]furan-2-carboxylate
CID 175731652
5-(4-acetylphenyl)-N-[2-(ethylamino)-2-oxoethyl]furan-2-carboxamide
CID 18145659
N-(4-methylphenyl)-5-(2-methyl-1,3-thiazol-4-yl)furan-2-carboxamide
CID 110383844

Frequently Asked Questions

What is the IUPAC name of 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide?
The IUPAC name of 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide (CID 9291217) is 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide is CC(=O)c1ccc(-c2ccc(C(=O)Nc3ccc(C)cc3)o2)cc1.
What is the InChIKey of 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide?
The InChIKey is BWQOBLDTAKDRJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO3/c1-13-3-9-17(10-4-13)21-20(23)19-12-11-18(24-19)16-7-5-15(6-8-16)14(2)22/h3-12H,1-2H3,(H,21,23).
What are the key properties of 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide?
5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide has a molecular weight of 319.36 g/mol, XLogP of 4.71, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-acetylphenyl)-N-(4-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 9291217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).