4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide

C26H25FN2O2 — CID 42803999

IUPAC4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide
SMILESCCCn1c(C(=O)Nc2ccc(C)cc2)cc2c(OCc3ccccc3F)cccc21
InChIInChI=1S/C26H25FN2O2/c1-3-15-29-23-9-6-10-25(31-17-19-7-4-5-8-22(19)27)21(23)16-24(29)26(30)28-20-13-11-18(2)12-14-20/h4-14,16H,3,15,17H2,1-2H3,(H,28,30)
InChIKeyQBNBVRAWQWUFMF-UHFFFAOYSA-N
MW416.50 g/mol
LogP6.33
Rot. Bonds7

About 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide

4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide (PubChem CID 42803999) has the molecular formula C26H25FN2O2 and a molecular weight of 416.50 g/mol. Its IUPAC name is 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide.

Molecular Properties

Compound Name4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide
PubChem CID42803999
Molecular FormulaC26H25FN2O2
Molecular Weight416.50 g/mol
Exact Mass416.19
IUPAC Name4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide
SMILESCCCn1c(C(=O)Nc2ccc(C)cc2)cc2c(OCc3ccccc3F)cccc21
InChIInChI=1S/C26H25FN2O2/c1-3-15-29-23-9-6-10-25(31-17-19-7-4-5-8-22(19)27)21(23)16-24(29)26(30)28-20-13-11-18(2)12-14-20/h4-14,16H,3,15,17H2,1-2H3,(H,28,30)
InChIKeyQBNBVRAWQWUFMF-UHFFFAOYSA-N
XLogP6.33
TPSA43.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.50
LogP ≤ 56.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-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

N-cyclohexyl-4-[(2-fluorophenyl)methoxy]-1-propylindole-2-carboxamide
CID 42803998
N-(4-fluorophenyl)-4-[(2-fluorophenyl)methoxy]-1-prop-2-enylindole-2-carboxamide
CID 42804636
4-[(2-fluorophenyl)methoxy]-1-(3-methylbut-2-enyl)indole-2-carboxylic acid
CID 42666942
N-[2-(3,4-dimethoxyphenyl)ethyl]-4-[(2-fluorophenyl)methoxy]-1-(3-methylbut-2-enyl)indole-2-carboxamide
CID 42804823
4-[(2-fluorophenyl)methoxy]-N-(furan-2-ylmethyl)-1-prop-2-enylindole-2-carboxamide
CID 42804635
N-(4-fluorophenyl)-7-methyl-1-oxo-2-propylisoquinoline-3-carboxamide
CID 172905785
2-[[2-[(2-fluorophenyl)methoxy]phenyl]methylideneamino]oxy-N-(4-methylphenyl)acetamide
CID 4272476
N-butyl-1-[(2-methylphenyl)methyl]-4-prop-2-enoxyindole-2-carboxamide
CID 42667169
(4-methylpiperidin-1-yl)-(4-phenylmethoxy-1-propylindol-2-yl)methanone
CID 42666955
6-methoxy-N-(4-methylphenyl)-1-oxo-2-propylisoquinoline-3-carboxamide
CID 175651926
N-(4-fluorophenyl)-1-heptyl-4-hydroxy-2-oxoquinoline-3-carboxamide
CID 54680778
4-hydroxy-2-oxo-N-(4-propoxyphenyl)-1-propylquinoline-3-carboxamide
CID 54696047

Frequently Asked Questions

What is the IUPAC name of 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide?
The IUPAC name of 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide (CID 42803999) is 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide.
What is the SMILES notation for 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide?
The canonical SMILES for 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide is CCCn1c(C(=O)Nc2ccc(C)cc2)cc2c(OCc3ccccc3F)cccc21.
What is the InChIKey of 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide?
The InChIKey is QBNBVRAWQWUFMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25FN2O2/c1-3-15-29-23-9-6-10-25(31-17-19-7-4-5-8-22(19)27)21(23)16-24(29)26(30)28-20-13-11-18(2)12-14-20/h4-14,16H,3,15,17H2,1-2H3,(H,28,30).
What are the key properties of 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide?
4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide has a molecular weight of 416.50 g/mol, XLogP of 6.33, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-fluorophenyl)methoxy]-N-(4-methylphenyl)-1-propylindole-2-carboxamide is sourced from PubChem (CID 42803999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).