N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide

C16H13FN2O — CID 43582640

IUPACN-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C16H13FN2O/c1-10-5-6-11(17)9-15(10)19-16(20)13-3-2-4-14-12(13)7-8-18-14/h2-9,18H,1H3,(H,19,20)
InChIKeyRFMKFELXDSEEFL-UHFFFAOYSA-N
MW268.29 g/mol
LogP3.87
Rot. Bonds2

About N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide

N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide (PubChem CID 43582640) has the molecular formula C16H13FN2O and a molecular weight of 268.29 g/mol. Its IUPAC name is N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide
PubChem CID43582640
Molecular FormulaC16H13FN2O
Molecular Weight268.29 g/mol
Exact Mass268.10
IUPAC NameN-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide
SMILESCc1ccc(F)cc1NC(=O)c1cccc2[nH]ccc12
InChIInChI=1S/C16H13FN2O/c1-10-5-6-11(17)9-15(10)19-16(20)13-3-2-4-14-12(13)7-8-18-14/h2-9,18H,1H3,(H,19,20)
InChIKeyRFMKFELXDSEEFL-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-(3,5-difluorophenyl)-1H-indole-4-carboxamide
CID 43582668
N-(5-fluoro-2-methylphenyl)-2,3-dimethylbenzamide
CID 7777709
N-(5-fluoro-2-methylphenyl)-2,3-dimethoxybenzamide
CID 2443471
N-(3-chloro-4-methylphenyl)-1H-indole-4-carboxamide
CID 43582392
N-(4-bromo-2,6-dimethylphenyl)-1H-indole-4-carboxamide
CID 43582014
N-(4-bromo-3,5-dimethylphenyl)-1H-indole-4-carboxamide
CID 107575074
3-amino-N-(5-fluoro-2-methylphenyl)-2-methylbenzamide
CID 16784018
2-bromo-N-(5-fluoro-2-methylphenyl)benzamide
CID 2683675
N-(4,6-dimethylpyrimidin-2-yl)-1H-indole-4-carboxamide
CID 43582943
N-(5-fluoro-2-methylphenyl)-2-(methanesulfonamido)benzamide
CID 51163852
2-fluoro-N-(1H-indol-4-yl)benzamide
CID 110730909
N-[(2,4-difluorophenyl)methyl]-1H-indole-4-carboxamide
CID 62227209

Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide?
The IUPAC name of N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide (CID 43582640) is N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide?
The canonical SMILES for N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide is Cc1ccc(F)cc1NC(=O)c1cccc2[nH]ccc12.
What is the InChIKey of N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide?
The InChIKey is RFMKFELXDSEEFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FN2O/c1-10-5-6-11(17)9-15(10)19-16(20)13-3-2-4-14-12(13)7-8-18-14/h2-9,18H,1H3,(H,19,20).
What are the key properties of N-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide?
N-(5-fluoro-2-methylphenyl)-1H-indole-4-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-(5-fluoro-2-methylphenyl)-1H-indole-4-carboxamide is sourced from PubChem (CID 43582640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).