N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide

C18H17FN2O — CID 40718604

IUPACN-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide
SMILESCn1cc(C(=O)NCCc2ccccc2F)c2ccccc21
InChIInChI=1S/C18H17FN2O/c1-21-12-15(14-7-3-5-9-17(14)21)18(22)20-11-10-13-6-2-4-8-16(13)19/h2-9,12H,10-11H2,1H3,(H,20,22)
InChIKeyHSYLUBOEFSOPNJ-UHFFFAOYSA-N
MW296.34 g/mol
LogP3.29
Rot. Bonds4

About N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide

N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide (PubChem CID 40718604) has the molecular formula C18H17FN2O and a molecular weight of 296.34 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide
PubChem CID40718604
Molecular FormulaC18H17FN2O
Molecular Weight296.34 g/mol
Exact Mass296.13
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide
SMILESCn1cc(C(=O)NCCc2ccccc2F)c2ccccc21
InChIInChI=1S/C18H17FN2O/c1-21-12-15(14-7-3-5-9-17(14)21)18(22)20-11-10-13-6-2-4-8-16(13)19/h2-9,12H,10-11H2,1H3,(H,20,22)
InChIKeyHSYLUBOEFSOPNJ-UHFFFAOYSA-N
XLogP3.29
TPSA34.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.34
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(2-fluorophenyl)ethyl]-1-methylindole-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-ethyl-1-methylindole-3-carboxamide
CID 25348690
1-methyl-N-(2-pyridin-2-ylethyl)indole-3-carboxamide
CID 29353033
2-(2-fluorophenyl)-N-[(1-methylindol-3-yl)methyl]acetamide
CID 110782275
N-[2-(2-fluorophenyl)ethyl]-1,3-dimethylpyrazole-4-carboxamide
CID 110852445
2-fluoro-N-[2-(5-hydroxy-1-methylindol-3-yl)ethyl]benzamide
CID 84579411
N-[2-(5-fluoro-1-methylindol-3-yl)ethyl]-1-methyl-2-oxoquinoline-4-carboxamide
CID 46976195
2-[2-[(1-methylindole-3-carbonyl)amino]ethylsulfanyl]acetic acid
CID 119241754
N-[2-(4-methoxyphenoxy)ethyl]-1-methylindole-3-carboxamide
CID 17492048
N-[2-(3,4-dimethoxyphenyl)ethyl]-1-methylindole-3-carboxamide
CID 9270076
1-methyl-N-[2-[5-(trifluoromethyl)-1,2,4-oxadiazol-3-yl]ethyl]indole-3-carboxamide
CID 90648306
N-[2-(1-methylindol-3-yl)ethyl]-2-phenylacetamide
CID 45069412
N-[(4-methoxyphenyl)methyl]-1-methylindole-3-carboxamide
CID 9208154

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide (CID 40718604) is N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide is Cn1cc(C(=O)NCCc2ccccc2F)c2ccccc21.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide?
The InChIKey is HSYLUBOEFSOPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O/c1-21-12-15(14-7-3-5-9-17(14)21)18(22)20-11-10-13-6-2-4-8-16(13)19/h2-9,12H,10-11H2,1H3,(H,20,22).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide?
N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide has a molecular weight of 296.34 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-1-methylindole-3-carboxamide is sourced from PubChem (CID 40718604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).