N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide

C22H19N3O — CID 121055646

IUPACN-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2cc(-c3cn4ccccc4n3)ccc2C)c1
InChIInChI=1S/C22H19N3O/c1-15-6-5-7-18(12-15)22(26)24-19-13-17(10-9-16(19)2)20-14-25-11-4-3-8-21(25)23-20/h3-14H,1-2H3,(H,24,26)
InChIKeyBTMYLWXPDKHXTM-UHFFFAOYSA-N
MW341.41 g/mol
LogP4.87
Rot. Bonds3

About N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide

N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide (PubChem CID 121055646) has the molecular formula C22H19N3O and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide.

Molecular Properties

Compound NameN-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide
PubChem CID121055646
Molecular FormulaC22H19N3O
Molecular Weight341.41 g/mol
Exact Mass341.15
IUPAC NameN-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide
SMILESCc1cccc(C(=O)Nc2cc(-c3cn4ccccc4n3)ccc2C)c1
InChIInChI=1S/C22H19N3O/c1-15-6-5-7-18(12-15)22(26)24-19-13-17(10-9-16(19)2)20-14-25-11-4-3-8-21(25)23-20/h3-14H,1-2H3,(H,24,26)
InChIKeyBTMYLWXPDKHXTM-UHFFFAOYSA-N
XLogP4.87
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 54.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide?
The IUPAC name of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide (CID 121055646) is N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide.
What is the SMILES notation for N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide?
The canonical SMILES for N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide is Cc1cccc(C(=O)Nc2cc(-c3cn4ccccc4n3)ccc2C)c1.
What is the InChIKey of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide?
The InChIKey is BTMYLWXPDKHXTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N3O/c1-15-6-5-7-18(12-15)22(26)24-19-13-17(10-9-16(19)2)20-14-25-11-4-3-8-21(25)23-20/h3-14H,1-2H3,(H,24,26).
What are the key properties of N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide?
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide has a molecular weight of 341.41 g/mol, XLogP of 4.87, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-3-methylbenzamide is sourced from PubChem (CID 121055646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).