2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide

C19H15Cl2N5O2 — CID 54015598

IUPAC2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide
SMILESCc1nc(Cc2c(C)nc3c(NC(=O)c4c(Cl)cccc4Cl)cccn23)no1
InChIInChI=1S/C19H15Cl2N5O2/c1-10-15(9-16-23-11(2)28-25-16)26-8-4-7-14(18(26)22-10)24-19(27)17-12(20)5-3-6-13(17)21/h3-8H,9H2,1-2H3,(H,24,27)
InChIKeyKVKHYPGAINRBFM-UHFFFAOYSA-N
MW416.27 g/mol
LogP4.48
Rot. Bonds4

About 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide

2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide (PubChem CID 54015598) has the molecular formula C19H15Cl2N5O2 and a molecular weight of 416.27 g/mol. Its IUPAC name is 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide.

Molecular Properties

Compound Name2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide
PubChem CID54015598
Molecular FormulaC19H15Cl2N5O2
Molecular Weight416.27 g/mol
Exact Mass415.06
IUPAC Name2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide
SMILESCc1nc(Cc2c(C)nc3c(NC(=O)c4c(Cl)cccc4Cl)cccn23)no1
InChIInChI=1S/C19H15Cl2N5O2/c1-10-15(9-16-23-11(2)28-25-16)26-8-4-7-14(18(26)22-10)24-19(27)17-12(20)5-3-6-13(17)21/h3-8H,9H2,1-2H3,(H,24,27)
InChIKeyKVKHYPGAINRBFM-UHFFFAOYSA-N
XLogP4.48
TPSA85.32 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500416.27
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide?
The IUPAC name of 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide (CID 54015598) is 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide.
What is the SMILES notation for 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide?
The canonical SMILES for 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide is Cc1nc(Cc2c(C)nc3c(NC(=O)c4c(Cl)cccc4Cl)cccn23)no1.
What is the InChIKey of 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide?
The InChIKey is KVKHYPGAINRBFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15Cl2N5O2/c1-10-15(9-16-23-11(2)28-25-16)26-8-4-7-14(18(26)22-10)24-19(27)17-12(20)5-3-6-13(17)21/h3-8H,9H2,1-2H3,(H,24,27).
What are the key properties of 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide?
2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide has a molecular weight of 416.27 g/mol, XLogP of 4.48, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dichloro-N-[2-methyl-3-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]imidazo[1,2-a]pyridin-8-yl]benzamide is sourced from PubChem (CID 54015598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).