N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide

C25H24F2N6O3 — CID 71280241

IUPACN-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2noc(C3CC(F)(F)C3)n2)cc1NC(=O)c1cnc2cc(N3CCOCC3)ccn12
InChIInChI=1S/C25H24F2N6O3/c1-15-2-3-16(22-30-24(36-31-22)17-12-25(26,27)13-17)10-19(15)29-23(34)20-14-28-21-11-18(4-5-33(20)21)32-6-8-35-9-7-32/h2-5,10-11,14,17H,6-9,12-13H2,1H3,(H,29,34)
InChIKeyQDBQXAHDNLLVQI-UHFFFAOYSA-N
MW494.50 g/mol
LogP4.29
Rot. Bonds5

About N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide

N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 71280241) has the molecular formula C25H24F2N6O3 and a molecular weight of 494.50 g/mol. Its IUPAC name is N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID71280241
Molecular FormulaC25H24F2N6O3
Molecular Weight494.50 g/mol
Exact Mass494.19
IUPAC NameN-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2noc(C3CC(F)(F)C3)n2)cc1NC(=O)c1cnc2cc(N3CCOCC3)ccn12
InChIInChI=1S/C25H24F2N6O3/c1-15-2-3-16(22-30-24(36-31-22)17-12-25(26,27)13-17)10-19(15)29-23(34)20-14-28-21-11-18(4-5-33(20)21)32-6-8-35-9-7-32/h2-5,10-11,14,17H,6-9,12-13H2,1H3,(H,29,34)
InChIKeyQDBQXAHDNLLVQI-UHFFFAOYSA-N
XLogP4.29
TPSA97.79 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500494.50
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

Analyze N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide with MolForge

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US9718828, Example, 291
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N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-6-(methoxymethyl)imidazo[1,2-a]pyridine-3-carboxamide
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6-fluoro-N-[5-[5-(3-hydroxycyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
CID 71280203
Tert-butyl (1-(3-(3-(imidazo[1,2-a]pyridine-3-carboxamido)-4-methylphenyl)-1,2,4-oxadiazol-5-yl)cyclopropyl)carbamate
CID 71280205
N-[2-methyl-5-[5-(3-oxocyclopentyl)-1,2,4-oxadiazol-3-yl]phenyl]imidazo[1,2-a]pyridine-3-carboxamide
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2-[4-[3-[[5-[5-(3,3-Difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]carbamoyl]imidazo[1,2-a]pyridin-6-yl]pyrazol-1-yl]acetic acid
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N-[5-[5-(3-fluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-methylimidazo[1,2-a]pyridine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide (CID 71280241) is N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(-c2noc(C3CC(F)(F)C3)n2)cc1NC(=O)c1cnc2cc(N3CCOCC3)ccn12.
What is the InChIKey of N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is QDBQXAHDNLLVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24F2N6O3/c1-15-2-3-16(22-30-24(36-31-22)17-12-25(26,27)13-17)10-19(15)29-23(34)20-14-28-21-11-18(4-5-33(20)21)32-6-8-35-9-7-32/h2-5,10-11,14,17H,6-9,12-13H2,1H3,(H,29,34).
What are the key properties of N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide?
N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 494.50 g/mol, XLogP of 4.29, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[5-(3,3-difluorocyclobutyl)-1,2,4-oxadiazol-3-yl]-2-methylphenyl]-7-morpholin-4-ylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 71280241), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).