2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide

C23H20ClFN4O2 — CID 24855619

IUPAC2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
SMILESCc1cccc(C)c1Nc1c(-c2cc(Cl)ccc2OCC(N)=O)nc2ccc(F)cn12
InChIInChI=1S/C23H20ClFN4O2/c1-13-4-3-5-14(2)21(13)28-23-22(27-20-9-7-16(25)11-29(20)23)17-10-15(24)6-8-18(17)31-12-19(26)30/h3-11,28H,12H2,1-2H3,(H2,26,30)
InChIKeySSGLZCDBELQHDJ-UHFFFAOYSA-N
MW438.89 g/mol
LogP5.02
Rot. Bonds6

About 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide

2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (PubChem CID 24855619) has the molecular formula C23H20ClFN4O2 and a molecular weight of 438.89 g/mol. Its IUPAC name is 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.

Molecular Properties

Compound Name2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
PubChem CID24855619
Molecular FormulaC23H20ClFN4O2
Molecular Weight438.89 g/mol
Exact Mass438.13
IUPAC Name2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide
SMILESCc1cccc(C)c1Nc1c(-c2cc(Cl)ccc2OCC(N)=O)nc2ccc(F)cn12
InChIInChI=1S/C23H20ClFN4O2/c1-13-4-3-5-14(2)21(13)28-23-22(27-20-9-7-16(25)11-29(20)23)17-10-15(24)6-8-18(17)31-12-19(26)30/h3-11,28H,12H2,1-2H3,(H2,26,30)
InChIKeySSGLZCDBELQHDJ-UHFFFAOYSA-N
XLogP5.02
TPSA81.65 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500438.89
LogP ≤ 55.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The IUPAC name of 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide (CID 24855619) is 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide.
What is the SMILES notation for 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The canonical SMILES for 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is Cc1cccc(C)c1Nc1c(-c2cc(Cl)ccc2OCC(N)=O)nc2ccc(F)cn12.
What is the InChIKey of 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
The InChIKey is SSGLZCDBELQHDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H20ClFN4O2/c1-13-4-3-5-14(2)21(13)28-23-22(27-20-9-7-16(25)11-29(20)23)17-10-15(24)6-8-18(17)31-12-19(26)30/h3-11,28H,12H2,1-2H3,(H2,26,30).
What are the key properties of 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide?
2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide has a molecular weight of 438.89 g/mol, XLogP of 5.02, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-chloro-2-[3-(2,6-dimethylanilino)-6-fluoroimidazo[1,2-a]pyridin-2-yl]phenoxy]acetamide is sourced from PubChem (CID 24855619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).