8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine

C17H10Cl2F3N3 — CID 58081135

IUPAC8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine
SMILESFC(F)(F)Cc1cnc2c(Cl)c(-c3cc(Cl)c4[nH]ccc4c3)ccn12
InChIInChI=1S/C17H10Cl2F3N3/c18-13-6-10(5-9-1-3-23-15(9)13)12-2-4-25-11(7-17(20,21)22)8-24-16(25)14(12)19/h1-6,8,23H,7H2
InChIKeyZNUAFMBRIADMMH-UHFFFAOYSA-N
MW384.19 g/mol
LogP5.89
Rot. Bonds2

About 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine

8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine (PubChem CID 58081135) has the molecular formula C17H10Cl2F3N3 and a molecular weight of 384.19 g/mol. Its IUPAC name is 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine
PubChem CID58081135
Molecular FormulaC17H10Cl2F3N3
Molecular Weight384.19 g/mol
Exact Mass383.02
IUPAC Name8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine
SMILESFC(F)(F)Cc1cnc2c(Cl)c(-c3cc(Cl)c4[nH]ccc4c3)ccn12
InChIInChI=1S/C17H10Cl2F3N3/c18-13-6-10(5-9-1-3-23-15(9)13)12-2-4-25-11(7-17(20,21)22)8-24-16(25)14(12)19/h1-6,8,23H,7H2
InChIKeyZNUAFMBRIADMMH-UHFFFAOYSA-N
XLogP5.89
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.19
LogP ≤ 55.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine (CID 58081135) is 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine is FC(F)(F)Cc1cnc2c(Cl)c(-c3cc(Cl)c4[nH]ccc4c3)ccn12.
What is the InChIKey of 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
The InChIKey is ZNUAFMBRIADMMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H10Cl2F3N3/c18-13-6-10(5-9-1-3-23-15(9)13)12-2-4-25-11(7-17(20,21)22)8-24-16(25)14(12)19/h1-6,8,23H,7H2.
What are the key properties of 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine has a molecular weight of 384.19 g/mol, XLogP of 5.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-chloro-7-(7-chloro-1H-indol-5-yl)-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 58081135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).