N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide

C23H20N2O3 — CID 158240240

IUPACN-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccc(Nc3ccccc3)c3c2C(=O)CC3)c1
InChIInChI=1S/C23H20N2O3/c1-28-17-9-5-6-15(14-17)23(27)25-20-12-11-19(18-10-13-21(26)22(18)20)24-16-7-3-2-4-8-16/h2-9,11-12,14,24H,10,13H2,1H3,(H,25,27)
InChIKeyGFLMBPVINNPKRT-UHFFFAOYSA-N
MW372.42 g/mol
LogP4.82
Rot. Bonds5

About N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide

N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide (PubChem CID 158240240) has the molecular formula C23H20N2O3 and a molecular weight of 372.42 g/mol. Its IUPAC name is N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide.

Molecular Properties

Compound NameN-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide
PubChem CID158240240
Molecular FormulaC23H20N2O3
Molecular Weight372.42 g/mol
Exact Mass372.15
IUPAC NameN-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide
SMILESCOc1cccc(C(=O)Nc2ccc(Nc3ccccc3)c3c2C(=O)CC3)c1
InChIInChI=1S/C23H20N2O3/c1-28-17-9-5-6-15(14-17)23(27)25-20-12-11-19(18-10-13-21(26)22(18)20)24-16-7-3-2-4-8-16/h2-9,11-12,14,24H,10,13H2,1H3,(H,25,27)
InChIKeyGFLMBPVINNPKRT-UHFFFAOYSA-N
XLogP4.82
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.42
LogP ≤ 54.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[7-(2,4-dimethoxyphenyl)-3-oxo-1,2-dihydroinden-4-yl]benzamide
CID 159920274
N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-4-(2-hydroxyethylamino)benzamide
CID 160848649
4-fluoro-N-[7-(2-methoxyanilino)-3-oxo-1,2-dihydroinden-4-yl]benzamide
CID 147109047
N-(4-benzamido-3-methylphenyl)-3-methoxybenzamide
CID 1365764
3-methoxy-N-(4-methyl-2-phenylphenyl)benzamide
CID 110441633
3-methoxy-N-[3-(phenylcarbamoylamino)phenyl]benzamide
CID 18153307
3-methoxy-N-(3-phenylphenyl)benzamide
CID 798645
2-[(3-methoxybenzoyl)amino]-N-(3-methoxyphenyl)benzamide
CID 51154923
3-hydroxy-4-[(3-methoxybenzoyl)amino]benzoic acid
CID 60827348
3-methylsulfanyl-N-(3-oxo-7-phenyl-1,2-dihydroinden-4-yl)benzamide
CID 162075474
3-N-(2-cyanophenyl)-1-N-(3-methoxyphenyl)benzene-1,3-dicarboxamide
CID 109057632
N-[7-(3-methylanilino)-3-oxo-1,2-dihydroisoindol-4-yl]benzamide
CID 122639190

Frequently Asked Questions

What is the IUPAC name of N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide?
The IUPAC name of N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide (CID 158240240) is N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide.
What is the SMILES notation for N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide?
The canonical SMILES for N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide is COc1cccc(C(=O)Nc2ccc(Nc3ccccc3)c3c2C(=O)CC3)c1.
What is the InChIKey of N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide?
The InChIKey is GFLMBPVINNPKRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20N2O3/c1-28-17-9-5-6-15(14-17)23(27)25-20-12-11-19(18-10-13-21(26)22(18)20)24-16-7-3-2-4-8-16/h2-9,11-12,14,24H,10,13H2,1H3,(H,25,27).
What are the key properties of N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide?
N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide has a molecular weight of 372.42 g/mol, XLogP of 4.82, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-anilino-3-oxo-1,2-dihydroinden-4-yl)-3-methoxybenzamide is sourced from PubChem (CID 158240240), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).