N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

C22H17F3N4O2 — CID 162763705

IUPACN-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccncc1NC(=O)c1cn2cccc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C22H17F3N4O2/c1-14-8-9-26-11-17(14)28-21(30)18-12-29-10-4-6-16(20(29)27-18)15-5-2-3-7-19(15)31-13-22(23,24)25/h2-12H,13H2,1H3,(H,28,30)
InChIKeyRPDFUSFBIRDFNX-UHFFFAOYSA-N
MW426.40 g/mol
LogP4.90
Rot. Bonds5

About N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide

N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (PubChem CID 162763705) has the molecular formula C22H17F3N4O2 and a molecular weight of 426.40 g/mol. Its IUPAC name is N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
PubChem CID162763705
Molecular FormulaC22H17F3N4O2
Molecular Weight426.40 g/mol
Exact Mass426.13
IUPAC NameN-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide
SMILESCc1ccncc1NC(=O)c1cn2cccc(-c3ccccc3OCC(F)(F)F)c2n1
InChIInChI=1S/C22H17F3N4O2/c1-14-8-9-26-11-17(14)28-21(30)18-12-29-10-4-6-16(20(29)27-18)15-5-2-3-7-19(15)31-13-22(23,24)25/h2-12H,13H2,1H3,(H,28,30)
InChIKeyRPDFUSFBIRDFNX-UHFFFAOYSA-N
XLogP4.90
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.40
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The IUPAC name of N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide (CID 162763705) is N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide.
What is the SMILES notation for N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The canonical SMILES for N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is Cc1ccncc1NC(=O)c1cn2cccc(-c3ccccc3OCC(F)(F)F)c2n1.
What is the InChIKey of N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
The InChIKey is RPDFUSFBIRDFNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17F3N4O2/c1-14-8-9-26-11-17(14)28-21(30)18-12-29-10-4-6-16(20(29)27-18)15-5-2-3-7-19(15)31-13-22(23,24)25/h2-12H,13H2,1H3,(H,28,30).
What are the key properties of N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide?
N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide has a molecular weight of 426.40 g/mol, XLogP of 4.90, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-pyridinyl)-8-[2-(2,2,2-trifluoroethoxy)phenyl]imidazo[1,2-a]pyridine-2-carboxamide is sourced from PubChem (CID 162763705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).