2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

C22H17ClFN3O — CID 121089949

IUPAC2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1ccn2cc(-c3ccc(C)c(NC(=O)c4ccc(F)cc4Cl)c3)nc2c1
InChIInChI=1S/C22H17ClFN3O/c1-13-7-8-27-12-20(25-21(27)9-13)15-4-3-14(2)19(10-15)26-22(28)17-6-5-16(24)11-18(17)23/h3-12H,1-2H3,(H,26,28)
InChIKeyIDVBOZPRWUNJIO-UHFFFAOYSA-N
MW393.85 g/mol
LogP5.66
Rot. Bonds3

About 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide

2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (PubChem CID 121089949) has the molecular formula C22H17ClFN3O and a molecular weight of 393.85 g/mol. Its IUPAC name is 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.

Molecular Properties

Compound Name2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
PubChem CID121089949
Molecular FormulaC22H17ClFN3O
Molecular Weight393.85 g/mol
Exact Mass393.10
IUPAC Name2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
SMILESCc1ccn2cc(-c3ccc(C)c(NC(=O)c4ccc(F)cc4Cl)c3)nc2c1
InChIInChI=1S/C22H17ClFN3O/c1-13-7-8-27-12-20(25-21(27)9-13)15-4-3-14(2)19(10-15)26-22(28)17-6-5-16(24)11-18(17)23/h3-12H,1-2H3,(H,26,28)
InChIKeyIDVBOZPRWUNJIO-UHFFFAOYSA-N
XLogP5.66
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500393.85
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]naphthalene-1-carboxamide
CID 121089943
2-(difluoromethylsulfanyl)-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 122283772
2-bromo-5-methoxy-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 122283799
3-bromo-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 121055687
5-bromo-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]pyridine-3-carboxamide
CID 122283713
2-(2,4-dichlorophenoxy)-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]acetamide
CID 121089952
3-cyano-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 122283755
2-chloro-N-[5-(6-fluoroimidazo[1,2-a]pyrimidin-2-yl)-2-methylphenyl]benzamide
CID 155091264
N-[2-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)anilino]-2-oxoethyl]benzamide
CID 121055785
N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-3-(3-methylphenyl)propanamide
CID 122283786
4-chloro-N-[2-methoxy-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide
CID 122322761
N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]-2-[3-(trifluoromethyl)phenyl]acetamide
CID 122283802

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The IUPAC name of 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide (CID 121089949) is 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide.
What is the SMILES notation for 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The canonical SMILES for 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is Cc1ccn2cc(-c3ccc(C)c(NC(=O)c4ccc(F)cc4Cl)c3)nc2c1.
What is the InChIKey of 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
The InChIKey is IDVBOZPRWUNJIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17ClFN3O/c1-13-7-8-27-12-20(25-21(27)9-13)15-4-3-14(2)19(10-15)26-22(28)17-6-5-16(24)11-18(17)23/h3-12H,1-2H3,(H,26,28).
What are the key properties of 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide?
2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide has a molecular weight of 393.85 g/mol, XLogP of 5.66, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-fluoro-N-[2-methyl-5-(7-methylimidazo[1,2-a]pyridin-2-yl)phenyl]benzamide is sourced from PubChem (CID 121089949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).