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

C19H17N5O3 — CID 71282403

IUPACN-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCOCc1noc(-c2ccc(C)c(NC(=O)c3cnc4ccccn34)c2)n1
InChIInChI=1S/C19H17N5O3/c1-12-6-7-13(19-22-16(11-26-2)23-27-19)9-14(12)21-18(25)15-10-20-17-5-3-4-8-24(15)17/h3-10H,11H2,1-2H3,(H,21,25)
InChIKeyMFDCMAULVVXFLY-UHFFFAOYSA-N
MW363.38 g/mol
LogP3.09
Rot. Bonds5

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

N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 71282403) has the molecular formula C19H17N5O3 and a molecular weight of 363.38 g/mol. Its IUPAC name is N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound NameN-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
PubChem CID71282403
Molecular FormulaC19H17N5O3
Molecular Weight363.38 g/mol
Exact Mass363.13
IUPAC NameN-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide
SMILESCOCc1noc(-c2ccc(C)c(NC(=O)c3cnc4ccccn34)c2)n1
InChIInChI=1S/C19H17N5O3/c1-12-6-7-13(19-22-16(11-26-2)23-27-19)9-14(12)21-18(25)15-10-20-17-5-3-4-8-24(15)17/h3-10H,11H2,1-2H3,(H,21,25)
InChIKeyMFDCMAULVVXFLY-UHFFFAOYSA-N
XLogP3.09
TPSA94.55 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide (CID 71282403) is N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is COCc1noc(-c2ccc(C)c(NC(=O)c3cnc4ccccn34)c2)n1.
What is the InChIKey of N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is MFDCMAULVVXFLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O3/c1-12-6-7-13(19-22-16(11-26-2)23-27-19)9-14(12)21-18(25)15-10-20-17-5-3-4-8-24(15)17/h3-10H,11H2,1-2H3,(H,21,25).
What are the key properties of N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide?
N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 363.38 g/mol, XLogP of 3.09, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-2-methylphenyl]imidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 71282403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).