6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

C22H21ClF3N3O3 — CID 162763674

IUPAC6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCC1(NC(=O)c2cn3cc(Cl)cc(-c4ccccc4OCC(F)(F)F)c3n2)CCCOC1
InChIInChI=1S/C22H21ClF3N3O3/c1-21(7-4-8-31-12-21)28-20(30)17-11-29-10-14(23)9-16(19(29)27-17)15-5-2-3-6-18(15)32-13-22(24,25)26/h2-3,5-6,9-11H,4,7-8,12-13H2,1H3,(H,28,30)
InChIKeyBVPRFKZMFGCZDU-UHFFFAOYSA-N
MW467.88 g/mol
LogP4.89
Rot. Bonds5

About 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 162763674) has the molecular formula C22H21ClF3N3O3 and a molecular weight of 467.88 g/mol. Its IUPAC name is 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID162763674
Molecular FormulaC22H21ClF3N3O3
Molecular Weight467.88 g/mol
Exact Mass467.12
IUPAC Name6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCC1(NC(=O)c2cn3cc(Cl)cc(-c4ccccc4OCC(F)(F)F)c3n2)CCCOC1
InChIInChI=1S/C22H21ClF3N3O3/c1-21(7-4-8-31-12-21)28-20(30)17-11-29-10-14(23)9-16(19(29)27-17)15-5-2-3-6-18(15)32-13-22(24,25)26/h2-3,5-6,9-11H,4,7-8,12-13H2,1H3,(H,28,30)
InChIKeyBVPRFKZMFGCZDU-UHFFFAOYSA-N
XLogP4.89
TPSA64.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500467.88
LogP ≤ 54.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

Telacebec
CID 68234908
6-chloro-N-[[4-[4-(4-chlorophenoxy)-1-piperidyl]phenyl]methyl]-2-ethyl-imidazo[1,2-a]pyridine-3-carboxamide
CID 67401709
7-chloro-2-ethyl-N-[[4-[[4-(trifluoromethoxy)phenyl]methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234745
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenyl]piperazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68235029
Aminoimidazo[1,2-a]pyridine deriv. 22
CID 5330640
Aminoimidazo[1,2-a]pyridine deriv. 23
CID 5330641
6-chloro-2-ethyl-N-[[4-[4-[[4-(trifluoromethoxy)phenyl]methyl]piperazin-1-yl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 53466897
6-chloro-2-ethyl-N-[[4-[4-[[4-(trifluoromethoxy)phenoxy]methyl]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 67403725
6-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenoxy]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234748
7-chloro-2-ethyl-N-[[4-[(4-fluorophenyl)methoxy]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234753
6-chloro-2-ethyl-N-[[4-[4-(4-fluorophenoxy)-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234767
7-chloro-2-ethyl-N-[[4-[4-[4-(trifluoromethoxy)phenoxy]-1-piperidyl]phenyl]methyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 68234859

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 162763674) is 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is CC1(NC(=O)c2cn3cc(Cl)cc(-c4ccccc4OCC(F)(F)F)c3n2)CCCOC1.
What is the InChIKey of 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is BVPRFKZMFGCZDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H21ClF3N3O3/c1-21(7-4-8-31-12-21)28-20(30)17-11-29-10-14(23)9-16(19(29)27-17)15-5-2-3-6-18(15)32-13-22(24,25)26/h2-3,5-6,9-11H,4,7-8,12-13H2,1H3,(H,28,30).
What are the key properties of 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 467.88 g/mol, XLogP of 4.89, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(3-methyloxan-3-yl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 162763674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).