3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

C18H11ClF3N3OS2 — CID 25190107

IUPAC3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccs1)c1nc2c(C(F)(F)F)cc(-c3cccs3)cn2c1Cl
InChIInChI=1S/C18H11ClF3N3OS2/c19-15-14(17(26)23-8-11-3-1-5-27-11)24-16-12(18(20,21)22)7-10(9-25(15)16)13-4-2-6-28-13/h1-7,9H,8H2,(H,23,26)
InChIKeyGGSCETUHPNEXJE-UHFFFAOYSA-N
MW441.89 g/mol
LogP5.73
Rot. Bonds4

About 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide

3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 25190107) has the molecular formula C18H11ClF3N3OS2 and a molecular weight of 441.89 g/mol. Its IUPAC name is 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID25190107
Molecular FormulaC18H11ClF3N3OS2
Molecular Weight441.89 g/mol
Exact Mass441.00
IUPAC Name3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccs1)c1nc2c(C(F)(F)F)cc(-c3cccs3)cn2c1Cl
InChIInChI=1S/C18H11ClF3N3OS2/c19-15-14(17(26)23-8-11-3-1-5-27-11)24-16-12(18(20,21)22)7-10(9-25(15)16)13-4-2-6-28-13/h1-7,9H,8H2,(H,23,26)
InChIKeyGGSCETUHPNEXJE-UHFFFAOYSA-N
XLogP5.73
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500441.89
LogP ≤ 55.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 25189938
3-chloro-6-thiophen-3-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 25189991
3-chloro-6-(furan-2-yl)-8-(trifluoromethyl)-N-[[2-(trifluoromethyl)phenyl]methyl]imidazo[1,2-a]pyridine-2-carboxamide
CID 25190166
3-chloro-8-(trifluoromethyl)-6-[4-(trifluoromethyl)phenyl]imidazo[1,2-a]pyridine-2-carboxylic acid;N-(thiophen-2-ylmethyl)decan-1-amine
CID 158715094
3-chloro-6-(furan-2-yl)-N-[2-(3-morpholin-4-ylpropylamino)-2-oxo-1-thiophen-2-ylethyl]-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 25190106
6-(furan-3-yl)-3-hydroxy-N-methyl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 162600792
3-[[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]amino]azetidine-1-carboxylic acid
CID 140539148
4-chloro-1-methyl-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)pyrazole-5-carboxamide
CID 4772994
3-chloro-6-(1,2-oxazol-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 68745272
4-(methylamino)-N-(thiophen-2-ylmethyl)-3-(trifluoromethyl)benzamide
CID 62165965
4,5-dichloro-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 110186920
5-bromo-N-(thiophen-2-ylmethyl)imidazo[2,1-b][1,3]thiazole-6-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (CID 25190107) is 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is O=C(NCc1cccs1)c1nc2c(C(F)(F)F)cc(-c3cccs3)cn2c1Cl.
What is the InChIKey of 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is GGSCETUHPNEXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClF3N3OS2/c19-15-14(17(26)23-8-11-3-1-5-27-11)24-16-12(18(20,21)22)7-10(9-25(15)16)13-4-2-6-28-13/h1-7,9H,8H2,(H,23,26).
What are the key properties of 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 441.89 g/mol, XLogP of 5.73, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 25190107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).