N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide

C19H19N3O2 — CID 110861432

IUPACN-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2c(C)[nH]c3cccc(C)c23)cc1
InChIInChI=1S/C19H19N3O2/c1-11-5-4-6-16-17(11)18(12(2)20-16)19(24)22-15-9-7-14(8-10-15)21-13(3)23/h4-10,20H,1-3H3,(H,21,23)(H,22,24)
InChIKeyCTVUHSDBCYBPQK-UHFFFAOYSA-N
MW321.38 g/mol
LogP4.00
Rot. Bonds3

About N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide

N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide (PubChem CID 110861432) has the molecular formula C19H19N3O2 and a molecular weight of 321.38 g/mol. Its IUPAC name is N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide.

Molecular Properties

Compound NameN-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide
PubChem CID110861432
Molecular FormulaC19H19N3O2
Molecular Weight321.38 g/mol
Exact Mass321.15
IUPAC NameN-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide
SMILESCC(=O)Nc1ccc(NC(=O)c2c(C)[nH]c3cccc(C)c23)cc1
InChIInChI=1S/C19H19N3O2/c1-11-5-4-6-16-17(11)18(12(2)20-16)19(24)22-15-9-7-14(8-10-15)21-13(3)23/h4-10,20H,1-3H3,(H,21,23)(H,22,24)
InChIKeyCTVUHSDBCYBPQK-UHFFFAOYSA-N
XLogP4.00
TPSA73.99 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.38
LogP ≤ 54.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Analyze N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide 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

N-(3-acetamidophenyl)-4-chloro-2-methyl-1H-indole-3-carboxamide
CID 110861279
N-(3-cyanophenyl)-2,4-dimethyl-1H-indole-3-carboxamide
CID 110864766
2-methyl-N-[4-(phenylcarbamoylamino)phenyl]-1H-indole-3-carboxamide
CID 24676897
N-(1,3-benzodioxol-5-yl)-4-fluoro-2-methyl-1H-indole-3-carboxamide
CID 110863160
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-fluoro-2-methyl-1H-indole-3-carboxamide
CID 110863302
2,5,6-trimethyl-N-(4-methylphenyl)-1H-indole-3-carboxamide
CID 135016973
N-(4-aminophenyl)-2,6-dimethylbenzamide
CID 114025945
1-(4-bromo-2-methyl-1H-indol-3-yl)ethanone
CID 82382387
4-fluoro-N-(2-methoxyphenyl)-2-methyl-1H-indole-3-carboxamide
CID 110859828
4-chloro-2-methyl-N-prop-2-enyl-1H-indole-3-carboxamide
CID 110848103
4-acetamido-N-(2-acetyl-3-methylphenyl)benzamide
CID 122150958
N-(3-formyl-2-methyl-1H-indol-5-yl)acetamide
CID 118108334

Frequently Asked Questions

What is the IUPAC name of N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide?
The IUPAC name of N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide (CID 110861432) is N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide.
What is the SMILES notation for N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide?
The canonical SMILES for N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide is CC(=O)Nc1ccc(NC(=O)c2c(C)[nH]c3cccc(C)c23)cc1.
What is the InChIKey of N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide?
The InChIKey is CTVUHSDBCYBPQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O2/c1-11-5-4-6-16-17(11)18(12(2)20-16)19(24)22-15-9-7-14(8-10-15)21-13(3)23/h4-10,20H,1-3H3,(H,21,23)(H,22,24).
What are the key properties of N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide?
N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide has a molecular weight of 321.38 g/mol, XLogP of 4.00, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetamidophenyl)-2,4-dimethyl-1H-indole-3-carboxamide is sourced from PubChem (CID 110861432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).