N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide

C16H13FN2O — CID 26699456

IUPACN-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide
SMILESCc1ccc(F)c(NC(=O)c2cc3ccccc3[nH]2)c1
InChIInChI=1S/C16H13FN2O/c1-10-6-7-12(17)14(8-10)19-16(20)15-9-11-4-2-3-5-13(11)18-15/h2-9,18H,1H3,(H,19,20)
InChIKeyAEXONLPCEHDAJC-UHFFFAOYSA-N
MW268.29 g/mol
LogP3.87
Rot. Bonds2

About N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide

N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide (PubChem CID 26699456) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide
PubChem CID26699456
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC NameN-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide
SMILESCc1ccc(F)c(NC(=O)c2cc3ccccc3[nH]2)c1
InChIInChI=1S/C16H13FN2O/c1-10-6-7-12(17)14(8-10)19-16(20)15-9-11-4-2-3-5-13(11)18-15/h2-9,18H,1H3,(H,19,20)
InChIKeyAEXONLPCEHDAJC-UHFFFAOYSA-N
XLogP3.87
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.29
LogP ≤ 53.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(5-bromo-2,4-difluorophenyl)-1H-indole-2-carboxamide
CID 102854713
N-(2,3-difluorophenyl)-1H-indole-2-carboxamide
CID 61077035
N-[2-(cyclopentanecarbonylamino)-5-methylphenyl]-1H-indole-2-carboxamide
CID 131946892
5-chloro-N-(2,5-dimethylphenyl)-1H-indole-2-carboxamide
CID 113207220
N-(4-chloro-2-iodophenyl)-1H-indole-2-carboxamide
CID 103766830
N-(2-fluoro-5-methylphenyl)-4-methylbenzamide
CID 7718843
N-(5-chloro-2-methoxyphenyl)-1H-indole-2-carboxamide
CID 9068762
5-fluoro-2-(1H-indole-2-carbonylamino)benzoic acid
CID 43823307
N-(2,4-dimethylphenyl)-5-fluoro-1H-indole-2-carboxamide
CID 46555971
5-methyl-N-phenyl-1H-indole-2-carboxamide
CID 3254922
N-(2-fluoro-5-methylphenyl)-2-hydrazinylbenzamide
CID 62243099
N-[2-(difluoromethoxy)phenyl]-1H-indole-2-carboxamide
CID 51145679

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide?
The IUPAC name of N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide (CID 26699456) is N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide?
The canonical SMILES for N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide is Cc1ccc(F)c(NC(=O)c2cc3ccccc3[nH]2)c1.
What is the InChIKey of N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide?
The InChIKey is AEXONLPCEHDAJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c1-10-6-7-12(17)14(8-10)19-16(20)15-9-11-4-2-3-5-13(11)18-15/h2-9,18H,1H3,(H,19,20).
What are the key properties of N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide?
N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide has a molecular weight of 268.29 g/mol, XLogP of 3.87, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-methylphenyl)-1H-indole-2-carboxamide is sourced from PubChem (CID 26699456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).