2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine

C20H15ClFN3 — CID 67231915

IUPAC2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(Cl)c(-c2nc3ccccn3c2Nc2ccccc2)c1F
InChIInChI=1S/C20H15ClFN3/c1-13-10-11-15(21)17(18(13)22)19-20(23-14-7-3-2-4-8-14)25-12-6-5-9-16(25)24-19/h2-12,23H,1H3
InChIKeyIOKOMEOIBPVTBF-UHFFFAOYSA-N
MW351.81 g/mol
LogP5.85
Rot. Bonds3

About 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine

2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine (PubChem CID 67231915) has the molecular formula C20H15ClFN3 and a molecular weight of 351.81 g/mol. Its IUPAC name is 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
PubChem CID67231915
Molecular FormulaC20H15ClFN3
Molecular Weight351.81 g/mol
Exact Mass351.09
IUPAC Name2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(Cl)c(-c2nc3ccccn3c2Nc2ccccc2)c1F
InChIInChI=1S/C20H15ClFN3/c1-13-10-11-15(21)17(18(13)22)19-20(23-14-7-3-2-4-8-14)25-12-6-5-9-16(25)24-19/h2-12,23H,1H3
InChIKeyIOKOMEOIBPVTBF-UHFFFAOYSA-N
XLogP5.85
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.81
LogP ≤ 55.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(3-chloro-2-fluorophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 91259410
2-(furan-2-yl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 6621186
N,2-bis(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 58564445
methyl 4-(3-anilinoimidazo[1,2-a]pyridin-2-yl)benzoate
CID 164601102
2-(3-methylimidazo[1,5-a]pyridin-1-yl)-N-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 174193271
2-(4-chlorophenyl)-N-(2,6-dimethylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 42738482
2-(4-nitrophenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 123510105
N-(4-fluorophenyl)-2-(4-methylsulfonylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 167713581
2-(2-methylpropyl)-N-phenylimidazo[1,2-a]pyridin-3-amine
CID 67230822
N,N-dimethyl-4-[(2-phenylimidazo[1,2-a]pyridin-3-yl)amino]benzamide
CID 102476670
N-(2,6-dimethylphenyl)-2-(3-methylthiophen-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 809322
5-(2-methylimidazo[1,2-a]pyridin-3-yl)-N-phenyl-1,3,4-thiadiazol-2-amine
CID 155486327

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine (CID 67231915) is 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine is Cc1ccc(Cl)c(-c2nc3ccccn3c2Nc2ccccc2)c1F.
What is the InChIKey of 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is IOKOMEOIBPVTBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFN3/c1-13-10-11-15(21)17(18(13)22)19-20(23-14-7-3-2-4-8-14)25-12-6-5-9-16(25)24-19/h2-12,23H,1H3.
What are the key properties of 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine?
2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 351.81 g/mol, XLogP of 5.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-2-fluoro-3-methylphenyl)-N-phenylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 67231915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).