N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide

C21H19N5O2 — CID 71280276

IUPACN-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2noc(C3CCC3)n2)cc1NC(=O)c1cnc2ccccn12
InChIInChI=1S/C21H19N5O2/c1-13-8-9-15(19-24-21(28-25-19)14-5-4-6-14)11-16(13)23-20(27)17-12-22-18-7-2-3-10-26(17)18/h2-3,7-12,14H,4-6H2,1H3,(H,23,27)
InChIKeyLAAFMNKBPFCIJU-UHFFFAOYSA-N
MW373.42 g/mol
LogP4.21
Rot. Bonds4

About N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide

N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 71280276) has the molecular formula C21H19N5O2 and a molecular weight of 373.42 g/mol. Its IUPAC name is N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID71280276
Molecular FormulaC21H19N5O2
Molecular Weight373.42 g/mol
Exact Mass373.15
IUPAC NameN-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCc1ccc(-c2noc(C3CCC3)n2)cc1NC(=O)c1cnc2ccccn12
InChIInChI=1S/C21H19N5O2/c1-13-8-9-15(19-24-21(28-25-19)14-5-4-6-14)11-16(13)23-20(27)17-12-22-18-7-2-3-10-26(17)18/h2-3,7-12,14H,4-6H2,1H3,(H,23,27)
InChIKeyLAAFMNKBPFCIJU-UHFFFAOYSA-N
XLogP4.21
TPSA85.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.42
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 71280276) is N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is Cc1ccc(-c2noc(C3CCC3)n2)cc1NC(=O)c1cnc2ccccn12.
What is the InChIKey of N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is LAAFMNKBPFCIJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5O2/c1-13-8-9-15(19-24-21(28-25-19)14-5-4-6-14)11-16(13)23-20(27)17-12-22-18-7-2-3-10-26(17)18/h2-3,7-12,14H,4-6H2,1H3,(H,23,27).
What are the key properties of N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 373.42 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(5-cyclobutyl-1,2,4-oxadiazol-3-yl)-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 71280276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).