5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide

C19H15NO3 — CID 684821

IUPAC5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(C(=O)c3ccccc3)o2)c1
InChIInChI=1S/C19H15NO3/c1-13-6-5-9-15(12-13)20-19(22)17-11-10-16(23-17)18(21)14-7-3-2-4-8-14/h2-12H,1H3,(H,20,22)
InChIKeyRIRAHWOZEDNSEZ-UHFFFAOYSA-N
MW305.33 g/mol
LogP4.07
Rot. Bonds4

About 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide

5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide (PubChem CID 684821) has the molecular formula C19H15NO3 and a molecular weight of 305.33 g/mol. Its IUPAC name is 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide
PubChem CID684821
Molecular FormulaC19H15NO3
Molecular Weight305.33 g/mol
Exact Mass305.11
IUPAC Name5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide
SMILESCc1cccc(NC(=O)c2ccc(C(=O)c3ccccc3)o2)c1
InChIInChI=1S/C19H15NO3/c1-13-6-5-9-15(12-13)20-19(22)17-11-10-16(23-17)18(21)14-7-3-2-4-8-14/h2-12H,1H3,(H,20,22)
InChIKeyRIRAHWOZEDNSEZ-UHFFFAOYSA-N
XLogP4.07
TPSA59.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.33
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide?
The IUPAC name of 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide (CID 684821) is 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide?
The canonical SMILES for 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide is Cc1cccc(NC(=O)c2ccc(C(=O)c3ccccc3)o2)c1.
What is the InChIKey of 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide?
The InChIKey is RIRAHWOZEDNSEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15NO3/c1-13-6-5-9-15(12-13)20-19(22)17-11-10-16(23-17)18(21)14-7-3-2-4-8-14/h2-12H,1H3,(H,20,22).
What are the key properties of 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide?
5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide has a molecular weight of 305.33 g/mol, XLogP of 4.07, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzoyl-N-(3-methylphenyl)furan-2-carboxamide is sourced from PubChem (CID 684821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).