4-methoxy-N-(4-oxochromen-6-yl)benzamide

C17H13NO4 — CID 22371111

IUPAC4-methoxy-N-(4-oxochromen-6-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc3occc(=O)c3c2)cc1
InChIInChI=1S/C17H13NO4/c1-21-13-5-2-11(3-6-13)17(20)18-12-4-7-16-14(10-12)15(19)8-9-22-16/h2-10H,1H3,(H,18,20)
InChIKeyRBONRCTZNOONJK-UHFFFAOYSA-N
MW295.29 g/mol
LogP3.05
Rot. Bonds3

About 4-methoxy-N-(4-oxochromen-6-yl)benzamide

4-methoxy-N-(4-oxochromen-6-yl)benzamide (PubChem CID 22371111) has the molecular formula C17H13NO4 and a molecular weight of 295.29 g/mol. Its IUPAC name is 4-methoxy-N-(4-oxochromen-6-yl)benzamide.

Molecular Properties

Compound Name4-methoxy-N-(4-oxochromen-6-yl)benzamide
PubChem CID22371111
Molecular FormulaC17H13NO4
Molecular Weight295.29 g/mol
Exact Mass295.08
IUPAC Name4-methoxy-N-(4-oxochromen-6-yl)benzamide
SMILESCOc1ccc(C(=O)Nc2ccc3occc(=O)c3c2)cc1
InChIInChI=1S/C17H13NO4/c1-21-13-5-2-11(3-6-13)17(20)18-12-4-7-16-14(10-12)15(19)8-9-22-16/h2-10H,1H3,(H,18,20)
InChIKeyRBONRCTZNOONJK-UHFFFAOYSA-N
XLogP3.05
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.29
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-methoxy-N-[2-(4-methoxyphenyl)-4-oxochromen-6-yl]benzamide
CID 18568776
5-methoxy-4-oxo-N-(4-oxochromen-6-yl)-1H-pyridine-2-carboxamide
CID 127252932
5-methoxy-4-oxo-N-(4-oxochromen-6-yl)pyran-2-carboxamide
CID 75491707
4-methoxy-N-(6,7,8,9-tetrahydrodibenzofuran-2-yl)benzamide
CID 24899449
4-methoxy-N-(2-methyl-4-oxo-1H-quinolin-6-yl)benzamide
CID 39849013
1-(4-chlorophenyl)-3-(4-oxochromen-6-yl)urea
CID 23139454
N-[3-chloro-5-[(4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 68786791
N-(3-hydroxy-4-methylphenyl)-4-methoxybenzamide
CID 1228319
methyl 4-[(4-methoxyphenyl)carbamoyl]benzoate
CID 7733773
5-bromo-N-[4-[(4-methoxyphenyl)carbamoyl]phenyl]-6-oxopyran-3-carboxamide
CID 1417940
N-ethyl-4-[(4-methoxybenzoyl)amino]benzamide
CID 17234279
4-methoxy-N-(3,4,5-trimethoxyphenyl)benzamide
CID 4198373

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-(4-oxochromen-6-yl)benzamide?
The IUPAC name of 4-methoxy-N-(4-oxochromen-6-yl)benzamide (CID 22371111) is 4-methoxy-N-(4-oxochromen-6-yl)benzamide.
What is the SMILES notation for 4-methoxy-N-(4-oxochromen-6-yl)benzamide?
The canonical SMILES for 4-methoxy-N-(4-oxochromen-6-yl)benzamide is COc1ccc(C(=O)Nc2ccc3occc(=O)c3c2)cc1.
What is the InChIKey of 4-methoxy-N-(4-oxochromen-6-yl)benzamide?
The InChIKey is RBONRCTZNOONJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13NO4/c1-21-13-5-2-11(3-6-13)17(20)18-12-4-7-16-14(10-12)15(19)8-9-22-16/h2-10H,1H3,(H,18,20).
What are the key properties of 4-methoxy-N-(4-oxochromen-6-yl)benzamide?
4-methoxy-N-(4-oxochromen-6-yl)benzamide has a molecular weight of 295.29 g/mol, XLogP of 3.05, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-(4-oxochromen-6-yl)benzamide is sourced from PubChem (CID 22371111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).