2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

C20H12Cl3N3O — CID 42658377

IUPAC2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(-c2cn3cc(Cl)cc(Cl)c3n2)c1)c1ccccc1Cl
InChIInChI=1S/C20H12Cl3N3O/c21-13-9-17(23)19-25-18(11-26(19)10-13)12-4-3-5-14(8-12)24-20(27)15-6-1-2-7-16(15)22/h1-11H,(H,24,27)
InChIKeyOOQTUEPFXZNYCE-UHFFFAOYSA-N
MW416.70 g/mol
LogP6.21
Rot. Bonds3

About 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (PubChem CID 42658377) has the molecular formula C20H12Cl3N3O and a molecular weight of 416.70 g/mol. Its IUPAC name is 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
PubChem CID42658377
Molecular FormulaC20H12Cl3N3O
Molecular Weight416.70 g/mol
Exact Mass415.00
IUPAC Name2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESO=C(Nc1cccc(-c2cn3cc(Cl)cc(Cl)c3n2)c1)c1ccccc1Cl
InChIInChI=1S/C20H12Cl3N3O/c21-13-9-17(23)19-25-18(11-26(19)10-13)12-4-3-5-14(8-12)24-20(27)15-6-1-2-7-16(15)22/h1-11H,(H,24,27)
InChIKeyOOQTUEPFXZNYCE-UHFFFAOYSA-N
XLogP6.21
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500416.70
LogP ≤ 56.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The IUPAC name of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (CID 42658377) is 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The canonical SMILES for 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is O=C(Nc1cccc(-c2cn3cc(Cl)cc(Cl)c3n2)c1)c1ccccc1Cl.
What is the InChIKey of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The InChIKey is OOQTUEPFXZNYCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H12Cl3N3O/c21-13-9-17(23)19-25-18(11-26(19)10-13)12-4-3-5-14(8-12)24-20(27)15-6-1-2-7-16(15)22/h1-11H,(H,24,27).
What are the key properties of 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide has a molecular weight of 416.70 g/mol, XLogP of 6.21, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[3-(6,8-dichloroimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is sourced from PubChem (CID 42658377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).