5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide

C15H9ClF2N2O — CID 113205928

IUPAC5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1c[nH]c2ccc(Cl)cc12
InChIInChI=1S/C15H9ClF2N2O/c16-8-1-3-13-10(5-8)11(7-19-13)15(21)20-14-4-2-9(17)6-12(14)18/h1-7,19H,(H,20,21)
InChIKeyKNWBKGQSUUDGEB-UHFFFAOYSA-N
MW306.70 g/mol
LogP4.35
Rot. Bonds2

About 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide

5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide (PubChem CID 113205928) has the molecular formula C15H9ClF2N2O and a molecular weight of 306.70 g/mol. Its IUPAC name is 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide.

Molecular Properties

Compound Name5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide
PubChem CID113205928
Molecular FormulaC15H9ClF2N2O
Molecular Weight306.70 g/mol
Exact Mass306.04
IUPAC Name5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1c[nH]c2ccc(Cl)cc12
InChIInChI=1S/C15H9ClF2N2O/c16-8-1-3-13-10(5-8)11(7-19-13)15(21)20-14-4-2-9(17)6-12(14)18/h1-7,19H,(H,20,21)
InChIKeyKNWBKGQSUUDGEB-UHFFFAOYSA-N
XLogP4.35
TPSA44.89 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.70
LogP ≤ 54.35
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

N-(4-chloro-2-methylphenyl)-5-fluoro-1H-indole-3-carboxamide
CID 113205698
N-(2,4-difluorophenyl)-6-fluoro-4-oxo-1H-quinoline-3-carboxamide
CID 39849781
N-(4-chloro-2-fluorophenyl)-2,4-difluorobenzamide
CID 2572466
N-(2-bromo-4-methylphenyl)-5-fluoro-1H-indole-3-carboxamide
CID 113205741
6-chloro-N-(2,3,4-trifluorophenyl)-1H-indole-3-carboxamide
CID 113206499
2-amino-5-chloro-N-(2,4-difluorophenyl)benzamide
CID 16796170
(5-chloro-1H-indol-3-yl)-(2,4,6-trifluorophenyl)methanone
CID 65101343
N-(4-chlorophenyl)-6-fluoro-1H-indole-3-carboxamide
CID 113206260
6-chloro-N-(3,5-difluorophenyl)-4-oxo-1H-quinoline-3-carboxamide
CID 17016539
(5-chloro-1H-indol-3-yl)-(3,5-difluorophenyl)methanone
CID 63878183
5-chloro-N-propan-2-yl-1H-indole-3-carboxamide
CID 69197000
5-chloro-N-(2,4-difluorophenyl)-2-(ethylamino)benzamide
CID 62166930

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide?
The IUPAC name of 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide (CID 113205928) is 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide.
What is the SMILES notation for 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide?
The canonical SMILES for 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide is O=C(Nc1ccc(F)cc1F)c1c[nH]c2ccc(Cl)cc12.
What is the InChIKey of 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide?
The InChIKey is KNWBKGQSUUDGEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9ClF2N2O/c16-8-1-3-13-10(5-8)11(7-19-13)15(21)20-14-4-2-9(17)6-12(14)18/h1-7,19H,(H,20,21).
What are the key properties of 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide?
5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide has a molecular weight of 306.70 g/mol, XLogP of 4.35, 2 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,4-difluorophenyl)-1H-indole-3-carboxamide is sourced from PubChem (CID 113205928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).