2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide

C24H19NO4 — CID 18568744

IUPAC2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc2oc(-c3ccc(C)cc3)cc(=O)c2c1
InChIInChI=1S/C24H19NO4/c1-15-7-9-16(10-8-15)23-14-20(26)19-13-17(11-12-22(19)29-23)25-24(27)18-5-3-4-6-21(18)28-2/h3-14H,1-2H3,(H,25,27)
InChIKeyPHZLFOSQSADQFW-UHFFFAOYSA-N
MW385.42 g/mol
LogP5.03
Rot. Bonds4

About 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide

2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide (PubChem CID 18568744) has the molecular formula C24H19NO4 and a molecular weight of 385.42 g/mol. Its IUPAC name is 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide.

Molecular Properties

Compound Name2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide
PubChem CID18568744
Molecular FormulaC24H19NO4
Molecular Weight385.42 g/mol
Exact Mass385.13
IUPAC Name2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide
SMILESCOc1ccccc1C(=O)Nc1ccc2oc(-c3ccc(C)cc3)cc(=O)c2c1
InChIInChI=1S/C24H19NO4/c1-15-7-9-16(10-8-15)23-14-20(26)19-13-17(11-12-22(19)29-23)25-24(27)18-5-3-4-6-21(18)28-2/h3-14H,1-2H3,(H,25,27)
InChIKeyPHZLFOSQSADQFW-UHFFFAOYSA-N
XLogP5.03
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500385.42
LogP ≤ 55.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[2-(3-methylphenyl)-4-oxochromen-6-yl]benzamide
CID 18568743
N-[2-(2-methoxyphenyl)-4-oxochromen-6-yl]-2-methylbenzamide
CID 18568738
2-bromo-N-[2-(4-methoxyphenyl)-4-oxochromen-6-yl]benzamide
CID 18568849
N-(3,4-dimethyl-2-oxochromen-6-yl)-2-methoxybenzamide;ethane
CID 144546170
4-methoxy-N-[2-(4-methoxyphenyl)-4-oxochromen-6-yl]benzamide
CID 18568776
3,5-dimethoxy-N-(4-oxo-2-phenylchromen-6-yl)benzamide
CID 18568778
N-[2-(4-tert-butylphenyl)-4-oxochromen-6-yl]-2-fluorobenzamide
CID 18568810
4-(6-methyl-4-oxochromen-2-yl)-N-(4-methylphenyl)benzamide
CID 108790164
3,4-dimethoxy-N-[2-(2-methoxyphenyl)-4-oxochromen-6-yl]benzamide
CID 16801698
N-(4-anilinophenyl)-4-(6-methyl-4-oxochromen-2-yl)benzamide
CID 108790282
N-[2-(3-methylphenyl)-4-oxochromen-6-yl]benzamide
CID 18568672
2-methoxy-N-[4-[4-[(2-methoxybenzoyl)amino]phenyl]phenyl]benzamide
CID 3299583

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide?
The IUPAC name of 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide (CID 18568744) is 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide.
What is the SMILES notation for 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide?
The canonical SMILES for 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide is COc1ccccc1C(=O)Nc1ccc2oc(-c3ccc(C)cc3)cc(=O)c2c1.
What is the InChIKey of 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide?
The InChIKey is PHZLFOSQSADQFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19NO4/c1-15-7-9-16(10-8-15)23-14-20(26)19-13-17(11-12-22(19)29-23)25-24(27)18-5-3-4-6-21(18)28-2/h3-14H,1-2H3,(H,25,27).
What are the key properties of 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide?
2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide has a molecular weight of 385.42 g/mol, XLogP of 5.03, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(4-methylphenyl)-4-oxochromen-6-yl]benzamide is sourced from PubChem (CID 18568744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).