(5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone

C15H7ClF3NO — CID 65101343

IUPAC(5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone
SMILESO=C(c1c(F)cc(F)cc1F)c1c[nH]c2ccc(Cl)cc12
InChIInChI=1S/C15H7ClF3NO/c16-7-1-2-13-9(3-7)10(6-20-13)15(21)14-11(18)4-8(17)5-12(14)19/h1-6,20H
InChIKeyQONUVGBMFRZZHB-UHFFFAOYSA-N
MW309.67 g/mol
LogP4.47
Rot. Bonds2

About (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone

(5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone (PubChem CID 65101343) has the molecular formula C15H7ClF3NO and a molecular weight of 309.67 g/mol. Its IUPAC name is (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone.

Molecular Properties

Compound Name(5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone
PubChem CID65101343
Molecular FormulaC15H7ClF3NO
Molecular Weight309.67 g/mol
Exact Mass309.02
IUPAC Name(5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone
SMILESO=C(c1c(F)cc(F)cc1F)c1c[nH]c2ccc(Cl)cc12
InChIInChI=1S/C15H7ClF3NO/c16-7-1-2-13-9(3-7)10(6-20-13)15(21)14-11(18)4-8(17)5-12(14)19/h1-6,20H
InChIKeyQONUVGBMFRZZHB-UHFFFAOYSA-N
XLogP4.47
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.67
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(5-chloro-1H-indol-3-yl)-(3,5-difluorophenyl)methanone
CID 63878183
(5-methyl-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone
CID 65101248
(5-chloro-1H-indol-3-yl)-(2,4,6-trimethylphenyl)methanone
CID 63878016
6-chloro-3-(4-fluorobenzoyl)-1H-quinolin-4-one
CID 22423715
5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide
CID 113205928
(5-chloro-1H-indol-3-yl)-(4-methylphenyl)methanone
CID 59430906
(5-chloro-1H-indol-3-yl)-(3,4-dichlorophenyl)methanone
CID 63877670
(3-chlorophenyl)-(5-fluoro-1H-indol-3-yl)methanone
CID 53414472
(5-chloro-1H-indol-3-yl)-(2-fluoro-4-methoxyphenyl)methanone
CID 102882260
(2-bromophenyl)-(5-chloro-1H-indol-3-yl)methanone
CID 55257460
(5-chloro-1H-indol-3-yl)-(2-methylsulfanylphenyl)methanone
CID 79215184
(5-chloro-1H-indol-3-yl)-(2,4-dibromophenyl)methanone
CID 107949887

Frequently Asked Questions

What is the IUPAC name of (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone?
The IUPAC name of (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone (CID 65101343) is (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone.
What is the SMILES notation for (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone?
The canonical SMILES for (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone is O=C(c1c(F)cc(F)cc1F)c1c[nH]c2ccc(Cl)cc12.
What is the InChIKey of (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone?
The InChIKey is QONUVGBMFRZZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H7ClF3NO/c16-7-1-2-13-9(3-7)10(6-20-13)15(21)14-11(18)4-8(17)5-12(14)19/h1-6,20H.
What are the key properties of (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone?
(5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone has a molecular weight of 309.67 g/mol, XLogP of 4.47, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone is sourced from PubChem (CID 65101343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).