3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide

C21H16ClN3O — CID 155524576

IUPAC3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide
SMILESCNC(=O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1
InChIInChI=1S/C21H16ClN3O/c1-23-21(26)16-4-2-3-15(11-16)17-7-10-20-24-19(13-25(20)12-17)14-5-8-18(22)9-6-14/h2-13H,1H3,(H,23,26)
InChIKeyQVGOFQSRONWZFN-UHFFFAOYSA-N
MW361.83 g/mol
LogP4.68
Rot. Bonds3

About 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide

3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide (PubChem CID 155524576) has the molecular formula C21H16ClN3O and a molecular weight of 361.83 g/mol. Its IUPAC name is 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide.

Molecular Properties

Compound Name3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide
PubChem CID155524576
Molecular FormulaC21H16ClN3O
Molecular Weight361.83 g/mol
Exact Mass361.10
IUPAC Name3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide
SMILESCNC(=O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1
InChIInChI=1S/C21H16ClN3O/c1-23-21(26)16-4-2-3-15(11-16)17-7-10-20-24-19(13-25(20)12-17)14-5-8-18(22)9-6-14/h2-13H,1H3,(H,23,26)
InChIKeyQVGOFQSRONWZFN-UHFFFAOYSA-N
XLogP4.68
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.83
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide?
The IUPAC name of 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide (CID 155524576) is 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide.
What is the SMILES notation for 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide?
The canonical SMILES for 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide is CNC(=O)c1cccc(-c2ccc3nc(-c4ccc(Cl)cc4)cn3c2)c1.
What is the InChIKey of 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide?
The InChIKey is QVGOFQSRONWZFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16ClN3O/c1-23-21(26)16-4-2-3-15(11-16)17-7-10-20-24-19(13-25(20)12-17)14-5-8-18(22)9-6-14/h2-13H,1H3,(H,23,26).
What are the key properties of 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide?
3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide has a molecular weight of 361.83 g/mol, XLogP of 4.68, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-6-yl]-N-methylbenzamide is sourced from PubChem (CID 155524576), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).