3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide

C18H18N2O2 — CID 14210891

IUPAC3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide
SMILESCOc1c(C(=O)Nc2ccc(C)cc2)n(C)c2ccccc12
InChIInChI=1S/C18H18N2O2/c1-12-8-10-13(11-9-12)19-18(21)16-17(22-3)14-6-4-5-7-15(14)20(16)2/h4-11H,1-3H3,(H,19,21)
InChIKeyVXWZZYRCQMTBLY-UHFFFAOYSA-N
MW294.35 g/mol
LogP3.75
Rot. Bonds3

About 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide

3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide (PubChem CID 14210891) has the molecular formula C18H18N2O2 and a molecular weight of 294.35 g/mol. Its IUPAC name is 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide.

Molecular Properties

Compound Name3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide
PubChem CID14210891
Molecular FormulaC18H18N2O2
Molecular Weight294.35 g/mol
Exact Mass294.14
IUPAC Name3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide
SMILESCOc1c(C(=O)Nc2ccc(C)cc2)n(C)c2ccccc12
InChIInChI=1S/C18H18N2O2/c1-12-8-10-13(11-9-12)19-18(21)16-17(22-3)14-6-4-5-7-15(14)20(16)2/h4-11H,1-3H3,(H,19,21)
InChIKeyVXWZZYRCQMTBLY-UHFFFAOYSA-N
XLogP3.75
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.35
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-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

3-methoxy-1-methylindole-2-carboxylic acid
CID 12619892
N-(4-ethylphenyl)-1,3-dimethylindole-2-carboxamide
CID 113204429
ethyl 3-methoxy-1-methylindole-2-carboxylate
CID 12619890
N-(2-methoxy-5-methylphenyl)-1,3-dimethylindole-2-carboxamide
CID 113204445
2-chloro-N-(4-methoxyphenyl)-1-methylindole-3-carboxamide
CID 1477196
methyl 2-[[2-[4-[(3-chloro-1-methylindole-2-carbonyl)amino]phenyl]acetyl]amino]acetate
CID 55964473
3-bromo-N-[4-(cyclopropylcarbamoylamino)phenyl]-1-methylindole-2-carboxamide
CID 55824808
1-methyl-N-phenyl-3-(pyrrolidine-1-carbonyl)indole-2-carboxamide
CID 170721777
1-methyl-N-[4-[(4-methylphenyl)sulfonylamino]phenyl]-2-oxoquinoline-4-carboxamide
CID 55787470
N-(5-chloro-2-methoxyphenyl)-1,3-dimethylindole-2-carboxamide
CID 113204438
1,3-dimethyl-N-propan-2-ylindole-2-carboxamide
CID 113204328
4-hydroxy-1-methyl-2-oxo-N-phenylquinoline-3-carboxamide
CID 54676449

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide?
The IUPAC name of 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide (CID 14210891) is 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide.
What is the SMILES notation for 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide?
The canonical SMILES for 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide is COc1c(C(=O)Nc2ccc(C)cc2)n(C)c2ccccc12.
What is the InChIKey of 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide?
The InChIKey is VXWZZYRCQMTBLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N2O2/c1-12-8-10-13(11-9-12)19-18(21)16-17(22-3)14-6-4-5-7-15(14)20(16)2/h4-11H,1-3H3,(H,19,21).
What are the key properties of 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide?
3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide has a molecular weight of 294.35 g/mol, XLogP of 3.75, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-1-methyl-N-(4-methylphenyl)indole-2-carboxamide is sourced from PubChem (CID 14210891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).