N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide

C20H20N2O2 — CID 802610

IUPACN-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(C)c(C=O)c3ccccc32)c(C)c1
InChIInChI=1S/C20H20N2O2/c1-13-8-9-18(14(2)10-13)21-20(24)11-22-15(3)17(12-23)16-6-4-5-7-19(16)22/h4-10,12H,11H2,1-3H3,(H,21,24)
InChIKeyLVTYUMDPDAHPRL-UHFFFAOYSA-N
MW320.39 g/mol
LogP4.02
Rot. Bonds4

About N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide

N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide (PubChem CID 802610) has the molecular formula C20H20N2O2 and a molecular weight of 320.39 g/mol. Its IUPAC name is N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide.

Molecular Properties

Compound NameN-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
PubChem CID802610
Molecular FormulaC20H20N2O2
Molecular Weight320.39 g/mol
Exact Mass320.15
IUPAC NameN-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
SMILESCc1ccc(NC(=O)Cn2c(C)c(C=O)c3ccccc32)c(C)c1
InChIInChI=1S/C20H20N2O2/c1-13-8-9-18(14(2)10-13)21-20(24)11-22-15(3)17(12-23)16-6-4-5-7-19(16)22/h4-10,12H,11H2,1-3H3,(H,21,24)
InChIKeyLVTYUMDPDAHPRL-UHFFFAOYSA-N
XLogP4.02
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(3-formyl-2-methylindol-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 976850
N-(2,3-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
CID 965806
N-(2,5-dichlorophenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide
CID 4201665
2-(3-formyl-2-methylindol-1-yl)acetate
CID 5175467
2-(3-butyl-2,4-dioxoquinazolin-1-yl)-N-(2,4-dimethylphenyl)acetamide
CID 45030658
N-(2,4-dimethylphenyl)-2-(2-oxo-1,3-benzoxazol-3-yl)acetamide
CID 1081528
2-(3-acetyl-2-methyl-5-phenylpyrrol-1-yl)-N-(2,4-dimethylphenyl)acetamide
CID 3672749
2-(2,4-dimethylanilino)-N'-[2-(9-oxoacridin-10-yl)acetyl]acetohydrazide
CID 55513954
N-[1-[2-(2,4-dimethylanilino)-2-oxoethyl]-2-hydroxyindol-3-yl]imino-2-hydroxybenzamide
CID 4264369
N-(2,4-dimethylphenyl)-2-[2-[(E)-2-phenylethenyl]benzimidazol-1-yl]acetamide
CID 17031753
2-(benzotriazol-1-yl)-N-(2,4-dimethylphenyl)acetamide
CID 856334
N-[(2-chlorophenyl)methyl]-5-[1-[2-(2,4-dimethylanilino)-2-oxoethyl]-2,4-dioxoquinazolin-3-yl]pentanamide
CID 22429771

Frequently Asked Questions

What is the IUPAC name of N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide?
The IUPAC name of N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide (CID 802610) is N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide.
What is the SMILES notation for N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide?
The canonical SMILES for N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide is Cc1ccc(NC(=O)Cn2c(C)c(C=O)c3ccccc32)c(C)c1.
What is the InChIKey of N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide?
The InChIKey is LVTYUMDPDAHPRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O2/c1-13-8-9-18(14(2)10-13)21-20(24)11-22-15(3)17(12-23)16-6-4-5-7-19(16)22/h4-10,12H,11H2,1-3H3,(H,21,24).
What are the key properties of N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide?
N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide has a molecular weight of 320.39 g/mol, XLogP of 4.02, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,4-dimethylphenyl)-2-(3-formyl-2-methylindol-1-yl)acetamide is sourced from PubChem (CID 802610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).