2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide

C15H12BrClN2O — CID 103806053

IUPAC2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
SMILESO=C(Nc1ccc2c(c1)CCN2)c1cc(Cl)ccc1Br
InChIInChI=1S/C15H12BrClN2O/c16-13-3-1-10(17)8-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-4,7-8,18H,5-6H2,(H,19,20)
InChIKeyFTAYCMCOYLOBNY-UHFFFAOYSA-N
MW351.63 g/mol
LogP4.32
Rot. Bonds2

About 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide

2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide (PubChem CID 103806053) has the molecular formula C15H12BrClN2O and a molecular weight of 351.63 g/mol. Its IUPAC name is 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide.

Molecular Properties

Compound Name2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
PubChem CID103806053
Molecular FormulaC15H12BrClN2O
Molecular Weight351.63 g/mol
Exact Mass349.98
IUPAC Name2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
SMILESO=C(Nc1ccc2c(c1)CCN2)c1cc(Cl)ccc1Br
InChIInChI=1S/C15H12BrClN2O/c16-13-3-1-10(17)8-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-4,7-8,18H,5-6H2,(H,19,20)
InChIKeyFTAYCMCOYLOBNY-UHFFFAOYSA-N
XLogP4.32
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.63
LogP ≤ 54.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-bromo-N-(2,3-dihydro-1H-indol-5-yl)-5-methylbenzamide
CID 81112809
2,4-dichloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
CID 63252988
5-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 63283438
5-bromo-N-(2,3-dihydro-1H-indol-5-yl)-2-methylbenzamide
CID 65312010
2,4-dichloro-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 63283086
4-chloro-N-(2,3-dihydro-1H-indol-5-yl)-2,5-difluorobenzamide
CID 82771926
2,5-dichloro-N-(2,3-dihydro-1H-indol-5-yl)thiophene-3-carboxamide
CID 103806044
3-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide
CID 55169715
5-chloro-N-(2,3-dihydro-1H-indol-5-yl)furan-2-carboxamide
CID 55168567
4-chloro-2-hydroxy-N-(1,2,3,4-tetrahydroquinolin-6-yl)benzamide
CID 63283394
N-(2,3-dihydro-1H-indol-5-yl)-2-fluoro-5-methylbenzamide
CID 63252982
2-bromo-N-(4-bromo-3-methylphenyl)-5-chlorobenzamide
CID 113221431

Frequently Asked Questions

What is the IUPAC name of 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide?
The IUPAC name of 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide (CID 103806053) is 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide.
What is the SMILES notation for 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide?
The canonical SMILES for 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide is O=C(Nc1ccc2c(c1)CCN2)c1cc(Cl)ccc1Br.
What is the InChIKey of 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide?
The InChIKey is FTAYCMCOYLOBNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12BrClN2O/c16-13-3-1-10(17)8-12(13)15(20)19-11-2-4-14-9(7-11)5-6-18-14/h1-4,7-8,18H,5-6H2,(H,19,20).
What are the key properties of 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide?
2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide has a molecular weight of 351.63 g/mol, XLogP of 4.32, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-5-chloro-N-(2,3-dihydro-1H-indol-5-yl)benzamide is sourced from PubChem (CID 103806053), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).