N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide

C26H26N2O4 — CID 22330317

IUPACN-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide
SMILESCOc1ccc(NC(=O)CCCn2c3ccccc3c(=O)c3cc(C)ccc32)c(OC)c1
InChIInChI=1S/C26H26N2O4/c1-17-10-13-23-20(15-17)26(30)19-7-4-5-8-22(19)28(23)14-6-9-25(29)27-21-12-11-18(31-2)16-24(21)32-3/h4-5,7-8,10-13,15-16H,6,9,14H2,1-3H3,(H,27,29)
InChIKeyFHUCOZHICLNGJH-UHFFFAOYSA-N
MW430.50 g/mol
LogP4.90
Rot. Bonds7

About N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide

N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide (PubChem CID 22330317) has the molecular formula C26H26N2O4 and a molecular weight of 430.50 g/mol. Its IUPAC name is N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide.

Molecular Properties

Compound NameN-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide
PubChem CID22330317
Molecular FormulaC26H26N2O4
Molecular Weight430.50 g/mol
Exact Mass430.19
IUPAC NameN-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide
SMILESCOc1ccc(NC(=O)CCCn2c3ccccc3c(=O)c3cc(C)ccc32)c(OC)c1
InChIInChI=1S/C26H26N2O4/c1-17-10-13-23-20(15-17)26(30)19-7-4-5-8-22(19)28(23)14-6-9-25(29)27-21-12-11-18(31-2)16-24(21)32-3/h4-5,7-8,10-13,15-16H,6,9,14H2,1-3H3,(H,27,29)
InChIKeyFHUCOZHICLNGJH-UHFFFAOYSA-N
XLogP4.90
TPSA69.56 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.50
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Related Compounds

N-(2,4-dimethoxyphenyl)-3-(4-methyl-2-oxoquinolin-1-yl)propanamide
CID 39763982
N-(9-ethylcarbazol-3-yl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide
CID 22330387
N-(2,4-dimethoxyphenyl)-2-(3-methyl-2,4-dioxoquinazolin-1-yl)acetamide
CID 6502390
ethyl 6-(2-methoxy-9-oxoacridin-10-yl)hexanoate
CID 66663531
N-(2,4-dimethoxyphenyl)-3-(2,5-dimethylpyrrol-1-yl)propanamide
CID 110689020
N-(2-bromophenyl)-4-(9-oxoacridin-10-yl)butanamide
CID 15998600
N-(2,4-dimethoxyphenyl)-5-hydroxypentanamide
CID 79019431
N-(2,4-dimethoxyphenyl)undecanamide
CID 4139645
N-(2,5-dimethoxyphenyl)-4-(2,4-dioxo-1H-quinazolin-3-yl)butanamide
CID 4902769
N-(2-chloro-4-fluorophenyl)-2-(2-methoxy-9-oxoacridin-10-yl)acetamide
CID 6616650
N-(2,4-dimethoxyphenyl)-2-(3-methyl-1-oxoisoquinolin-2-yl)acetamide
CID 5058844
2-(2-methoxy-9-oxoacridin-10-yl)-N-(3-methoxyphenyl)acetamide
CID 15992736

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide?
The IUPAC name of N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide (CID 22330317) is N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide.
What is the SMILES notation for N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide?
The canonical SMILES for N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide is COc1ccc(NC(=O)CCCn2c3ccccc3c(=O)c3cc(C)ccc32)c(OC)c1.
What is the InChIKey of N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide?
The InChIKey is FHUCOZHICLNGJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O4/c1-17-10-13-23-20(15-17)26(30)19-7-4-5-8-22(19)28(23)14-6-9-25(29)27-21-12-11-18(31-2)16-24(21)32-3/h4-5,7-8,10-13,15-16H,6,9,14H2,1-3H3,(H,27,29).
What are the key properties of N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide?
N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide has a molecular weight of 430.50 g/mol, XLogP of 4.90, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethoxyphenyl)-4-(2-methyl-9-oxoacridin-10-yl)butanamide is sourced from PubChem (CID 22330317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).