5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide

C18H13NO4 — CID 777098

IUPAC5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1ccc(C(=O)c2ccccc2)o1
InChIInChI=1S/C18H13NO4/c20-14-8-6-13(7-9-14)19-18(22)16-11-10-15(23-16)17(21)12-4-2-1-3-5-12/h1-11,20H,(H,19,22)
InChIKeyIUIBKDKWQPVVPJ-UHFFFAOYSA-N
MW307.31 g/mol
LogP3.47
Rot. Bonds4

About 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide

5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide (PubChem CID 777098) has the molecular formula C18H13NO4 and a molecular weight of 307.31 g/mol. Its IUPAC name is 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide
PubChem CID777098
Molecular FormulaC18H13NO4
Molecular Weight307.31 g/mol
Exact Mass307.08
IUPAC Name5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide
SMILESO=C(Nc1ccc(O)cc1)c1ccc(C(=O)c2ccccc2)o1
InChIInChI=1S/C18H13NO4/c20-14-8-6-13(7-9-14)19-18(22)16-11-10-15(23-16)17(21)12-4-2-1-3-5-12/h1-11,20H,(H,19,22)
InChIKeyIUIBKDKWQPVVPJ-UHFFFAOYSA-N
XLogP3.47
TPSA79.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.31
LogP ≤ 53.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroquinone', 'substructure': 'N/A'}

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Related Compounds

(5-benzoylfuran-2-yl)-phenylmethanone
CID 22336637
5-bromo-N-(4-hydroxyphenyl)furan-2-carboxamide
CID 973213
5-benzoylfuran-2-carboxylate
CID 5064810
N-[4-(2-benzoylhydrazinyl)phenyl]benzamide
CID 23454945
(4-hydroxyphenyl)-phenylmethanone
CID 139062648
N-[4-(phenoxymethyl)phenyl]benzamide
CID 141092226
5-bromo-N-(4-phenylphenyl)furan-2-carboxamide
CID 6624475
N-[4-(sulfanylmethyl)phenyl]benzamide
CID 130322927
N-(4-ethylphenyl)benzamide
CID 774063
5-bromo-N-(4-phenyldiazenylphenyl)furan-2-carboxamide
CID 3406026
2-[4-[(5-phenylfuran-2-carbonyl)amino]phenyl]acetic acid
CID 59654726
(4-benzamidophenyl)carbamic acid
CID 18543096

Frequently Asked Questions

What is the IUPAC name of 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide?
The IUPAC name of 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide (CID 777098) is 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide.
What is the SMILES notation for 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide?
The canonical SMILES for 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide is O=C(Nc1ccc(O)cc1)c1ccc(C(=O)c2ccccc2)o1.
What is the InChIKey of 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide?
The InChIKey is IUIBKDKWQPVVPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13NO4/c20-14-8-6-13(7-9-14)19-18(22)16-11-10-15(23-16)17(21)12-4-2-1-3-5-12/h1-11,20H,(H,19,22).
What are the key properties of 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide?
5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide has a molecular weight of 307.31 g/mol, XLogP of 3.47, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzoyl-N-(4-hydroxyphenyl)furan-2-carboxamide is sourced from PubChem (CID 777098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).