1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide

C22H18N2O2 — CID 112523940

IUPAC1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide
SMILESCn1ccc2c(C(=O)Nc3ccc(Oc4ccccc4)cc3)cccc21
InChIInChI=1S/C22H18N2O2/c1-24-15-14-19-20(8-5-9-21(19)24)22(25)23-16-10-12-18(13-11-16)26-17-6-3-2-4-7-17/h2-15H,1H3,(H,23,25)
InChIKeyMOUCZWRTMJQFBJ-UHFFFAOYSA-N
MW342.40 g/mol
LogP5.22
Rot. Bonds4

About 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide

1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide (PubChem CID 112523940) has the molecular formula C22H18N2O2 and a molecular weight of 342.40 g/mol. Its IUPAC name is 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide
PubChem CID112523940
Molecular FormulaC22H18N2O2
Molecular Weight342.40 g/mol
Exact Mass342.14
IUPAC Name1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide
SMILESCn1ccc2c(C(=O)Nc3ccc(Oc4ccccc4)cc3)cccc21
InChIInChI=1S/C22H18N2O2/c1-24-15-14-19-20(8-5-9-21(19)24)22(25)23-16-10-12-18(13-11-16)26-17-6-3-2-4-7-17/h2-15H,1H3,(H,23,25)
InChIKeyMOUCZWRTMJQFBJ-UHFFFAOYSA-N
XLogP5.22
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.40
LogP ≤ 55.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-methyl-N-(4-phenoxyphenyl)indole-4-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

2,3-dimethoxy-N-(4-phenoxyphenyl)benzamide
CID 912370
1-methyl-N-(3-methylsulfanylphenyl)indole-4-carboxamide
CID 51053502
2-iodo-N-(4-phenoxyphenyl)benzamide
CID 1010138
1-methyl-N-phenylindole-3-carboxamide
CID 9038340
N-(2-ethoxyphenyl)-1-methylindole-4-carboxamide
CID 112522704
N-(5-acetamido-2-methoxyphenyl)-1-methylindole-4-carboxamide
CID 51108315
[4-(pyridin-3-ylcarbamoyl)phenyl] 1-methylindole-4-carboxylate
CID 86882782
2-methyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
CID 110862622
N-[4-fluoro-3-(prop-2-enoylamino)phenyl]-1-methylindole-4-carboxamide
CID 166405453
2-methylsulfanyl-N-(4-phenoxyphenyl)pyridine-3-carboxamide
CID 2111300
N-(1H-indazol-3-yl)-1-methylindole-4-carboxamide
CID 112527943
1-N,3-N-bis(4-phenoxyphenyl)benzene-1,3-dicarboxamide
CID 3090014

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide?
The IUPAC name of 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide (CID 112523940) is 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide.
What is the SMILES notation for 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide?
The canonical SMILES for 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide is Cn1ccc2c(C(=O)Nc3ccc(Oc4ccccc4)cc3)cccc21.
What is the InChIKey of 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide?
The InChIKey is MOUCZWRTMJQFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H18N2O2/c1-24-15-14-19-20(8-5-9-21(19)24)22(25)23-16-10-12-18(13-11-16)26-17-6-3-2-4-7-17/h2-15H,1H3,(H,23,25).
What are the key properties of 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide?
1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide has a molecular weight of 342.40 g/mol, XLogP of 5.22, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(4-phenoxyphenyl)indole-4-carboxamide is sourced from PubChem (CID 112523940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).