5-benzoyl-N,N-diethylfuran-2-carboxamide

C16H17NO3 — CID 692790

IUPAC5-benzoyl-N,N-diethylfuran-2-carboxamide
SMILESCCN(CC)C(=O)c1ccc(C(=O)c2ccccc2)o1
InChIInChI=1S/C16H17NO3/c1-3-17(4-2)16(19)14-11-10-13(20-14)15(18)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3
InChIKeyKBGWMFPXVOOLSD-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.99
Rot. Bonds5

About 5-benzoyl-N,N-diethylfuran-2-carboxamide

5-benzoyl-N,N-diethylfuran-2-carboxamide (PubChem CID 692790) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is 5-benzoyl-N,N-diethylfuran-2-carboxamide.

Molecular Properties

Compound Name5-benzoyl-N,N-diethylfuran-2-carboxamide
PubChem CID692790
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Name5-benzoyl-N,N-diethylfuran-2-carboxamide
SMILESCCN(CC)C(=O)c1ccc(C(=O)c2ccccc2)o1
InChIInChI=1S/C16H17NO3/c1-3-17(4-2)16(19)14-11-10-13(20-14)15(18)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3
InChIKeyKBGWMFPXVOOLSD-UHFFFAOYSA-N
XLogP2.99
TPSA50.52 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5-benzoylfuran-2-yl)-phenylmethanone
CID 22336637
5-benzoylfuran-2-carboxylate
CID 5064810
5-(bromomethyl)-N,N-diethylfuran-2-carboxamide
CID 134860219
CID 174412487
CID 174412487
N,N-diethyl-4-(3-phenylpropyl)benzamide
CID 102226026
5-[ethyl(2-methylprop-2-enyl)carbamoyl]furan-2-carboxylic acid
CID 75356028
tripotassium;N,N-diethylbenzamide;tritetrafluoroborate
CID 121234148
N-[2-(diethylamino)-2-oxoethyl]-N-methylbenzamide
CID 60668984
N,N-diethyl-4-oxo-4-phenylbutanamide
CID 10399096
N-(1,3-benzodioxol-5-ylmethyl)-N-ethylbenzamide
CID 60655508
2-N,5-N-dimethyl-2-N,5-N-diphenylfuran-2,5-dicarboxamide
CID 154862775
N,N-diethyl-2-(4-phenylphenyl)acetamide
CID 52895246

Frequently Asked Questions

What is the IUPAC name of 5-benzoyl-N,N-diethylfuran-2-carboxamide?
The IUPAC name of 5-benzoyl-N,N-diethylfuran-2-carboxamide (CID 692790) is 5-benzoyl-N,N-diethylfuran-2-carboxamide.
What is the SMILES notation for 5-benzoyl-N,N-diethylfuran-2-carboxamide?
The canonical SMILES for 5-benzoyl-N,N-diethylfuran-2-carboxamide is CCN(CC)C(=O)c1ccc(C(=O)c2ccccc2)o1.
What is the InChIKey of 5-benzoyl-N,N-diethylfuran-2-carboxamide?
The InChIKey is KBGWMFPXVOOLSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-3-17(4-2)16(19)14-11-10-13(20-14)15(18)12-8-6-5-7-9-12/h5-11H,3-4H2,1-2H3.
What are the key properties of 5-benzoyl-N,N-diethylfuran-2-carboxamide?
5-benzoyl-N,N-diethylfuran-2-carboxamide has a molecular weight of 271.32 g/mol, XLogP of 2.99, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzoyl-N,N-diethylfuran-2-carboxamide is sourced from PubChem (CID 692790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).