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

C18H11ClF3N3O2S — CID 25189938

IUPAC3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccs1)c1nc2c(C(F)(F)F)cc(-c3ccoc3)cn2c1Cl
InChIInChI=1S/C18H11ClF3N3O2S/c19-15-14(17(26)23-7-12-2-1-5-28-12)24-16-13(18(20,21)22)6-11(8-25(15)16)10-3-4-27-9-10/h1-6,8-9H,7H2,(H,23,26)
InChIKeyMLNKUFFJDSIZFT-UHFFFAOYSA-N
MW425.82 g/mol
LogP5.26
Rot. Bonds4

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

3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 25189938) has the molecular formula C18H11ClF3N3O2S and a molecular weight of 425.82 g/mol. Its IUPAC name is 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID25189938
Molecular FormulaC18H11ClF3N3O2S
Molecular Weight425.82 g/mol
Exact Mass425.02
IUPAC Name3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
SMILESO=C(NCc1cccs1)c1nc2c(C(F)(F)F)cc(-c3ccoc3)cn2c1Cl
InChIInChI=1S/C18H11ClF3N3O2S/c19-15-14(17(26)23-7-12-2-1-5-28-12)24-16-13(18(20,21)22)6-11(8-25(15)16)10-3-4-27-9-10/h1-6,8-9H,7H2,(H,23,26)
InChIKeyMLNKUFFJDSIZFT-UHFFFAOYSA-N
XLogP5.26
TPSA59.54 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500425.82
LogP ≤ 55.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-chloro-6-thiophen-2-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 25190107
3-chloro-6-thiophen-3-yl-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 25189991
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
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-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-[4-(cyclopropylmethylamino)piperidin-1-yl]methanone
CID 59443786
3-chloro-N-[2-[(3,3-dimethylcyclobutyl)amino]-2-oxoethyl]-6-(furan-3-yl)-N-(2-hydroxyethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide
CID 67085272
4-[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]-1-propan-2-ylpiperazin-2-one
CID 51357842
3-[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]-3-thiophen-2-ylpyrrolidine-1-carbaldehyde
CID 141234017
4-[3-chloro-6-(furan-3-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carbonyl]-1-(3,4-difluorohepta-2,4-dienyl)piperazin-2-one
CID 123602392
3-chloro-6-(1,2-oxazol-4-yl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxylic acid
CID 68745272

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide (CID 25189938) is 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is O=C(NCc1cccs1)c1nc2c(C(F)(F)F)cc(-c3ccoc3)cn2c1Cl.
What is the InChIKey of 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is MLNKUFFJDSIZFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H11ClF3N3O2S/c19-15-14(17(26)23-7-12-2-1-5-28-12)24-16-13(18(20,21)22)6-11(8-25(15)16)10-3-4-27-9-10/h1-6,8-9H,7H2,(H,23,26).
What are the key properties of 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide?
3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 425.82 g/mol, XLogP of 5.26, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-6-(furan-3-yl)-N-(thiophen-2-ylmethyl)-8-(trifluoromethyl)imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 25189938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).