N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

C24H20ClF2N3O3 — CID 90115323

IUPACN-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)NC(CO)c1ccc(Cl)cc1
InChIInChI=1S/C24H20ClF2N3O3/c1-14-22(24(32)29-20(12-31)15-7-9-16(25)10-8-15)30-11-3-6-21(23(30)28-14)33-13-17-18(26)4-2-5-19(17)27/h2-11,20,31H,12-13H2,1H3,(H,29,32)
InChIKeySVFSVDXZALQZCY-UHFFFAOYSA-N
MW471.89 g/mol
LogP4.62
Rot. Bonds7

About N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide

N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 90115323) has the molecular formula C24H20ClF2N3O3 and a molecular weight of 471.89 g/mol. Its IUPAC name is N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID90115323
Molecular FormulaC24H20ClF2N3O3
Molecular Weight471.89 g/mol
Exact Mass471.12
IUPAC NameN-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)NC(CO)c1ccc(Cl)cc1
InChIInChI=1S/C24H20ClF2N3O3/c1-14-22(24(32)29-20(12-31)15-7-9-16(25)10-8-15)30-11-3-6-21(23(30)28-14)33-13-17-18(26)4-2-5-19(17)27/h2-11,20,31H,12-13H2,1H3,(H,29,32)
InChIKeySVFSVDXZALQZCY-UHFFFAOYSA-N
XLogP4.62
TPSA75.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500471.89
LogP ≤ 54.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide (CID 90115323) is N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is Cc1nc2c(OCc3c(F)cccc3F)cccn2c1C(=O)NC(CO)c1ccc(Cl)cc1.
What is the InChIKey of N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is SVFSVDXZALQZCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20ClF2N3O3/c1-14-22(24(32)29-20(12-31)15-7-9-16(25)10-8-15)30-11-3-6-21(23(30)28-14)33-13-17-18(26)4-2-5-19(17)27/h2-11,20,31H,12-13H2,1H3,(H,29,32).
What are the key properties of N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide?
N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 471.89 g/mol, XLogP of 4.62, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-chlorophenyl)-2-hydroxyethyl]-8-[(2,6-difluorophenyl)methoxy]-2-methylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 90115323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).