2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine

C15H12FN3O — CID 82356789

IUPAC2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine
SMILESCc1ccc(-c2nc3ccc(F)cn3c2N=O)c(C)c1
InChIInChI=1S/C15H12FN3O/c1-9-3-5-12(10(2)7-9)14-15(18-20)19-8-11(16)4-6-13(19)17-14/h3-8H,1-2H3
InChIKeyUQGGKIAEZGAQHX-UHFFFAOYSA-N
MW269.28 g/mol
LogP4.16
Rot. Bonds2

About 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine

2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine (PubChem CID 82356789) has the molecular formula C15H12FN3O and a molecular weight of 269.28 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine
PubChem CID82356789
Molecular FormulaC15H12FN3O
Molecular Weight269.28 g/mol
Exact Mass269.10
IUPAC Name2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine
SMILESCc1ccc(-c2nc3ccc(F)cn3c2N=O)c(C)c1
InChIInChI=1S/C15H12FN3O/c1-9-3-5-12(10(2)7-9)14-15(18-20)19-8-11(16)4-6-13(19)17-14/h3-8H,1-2H3
InChIKeyUQGGKIAEZGAQHX-UHFFFAOYSA-N
XLogP4.16
TPSA46.73 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.28
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-methoxy-2-methylphenyl)-6-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356459
2-[2-(2,4-dimethylphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82060558
6-fluoro-2-(4-methoxy-3-methylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356749
2-(4-methoxy-2,5-dimethylphenyl)-6-methyl-3-nitrosoimidazo[1,2-a]pyridine
CID 82356466
6-chloro-2-(5-chloro-2-methylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 95967161
6-chloro-2-(4-fluoro-3-methylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356825
6-fluoro-2-(4-nitrophenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356743
6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine
CID 82356752
ethyl 6-fluoro-3-nitrosoimidazo[1,2-a]pyridine-2-carboxylate
CID 82356768
2-(2,4-dimethylphenyl)-N-ethyl-3-methylimidazo[1,2-a]pyridin-6-amine
CID 82059764
3-(1-chloroethyl)-2-(2,4-dimethylphenyl)-6-methylimidazo[1,2-a]pyridine
CID 82029821
2-(2,5-difluorophenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356270

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine?
The IUPAC name of 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine (CID 82356789) is 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine.
What is the SMILES notation for 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine?
The canonical SMILES for 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine is Cc1ccc(-c2nc3ccc(F)cn3c2N=O)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine?
The InChIKey is UQGGKIAEZGAQHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12FN3O/c1-9-3-5-12(10(2)7-9)14-15(18-20)19-8-11(16)4-6-13(19)17-14/h3-8H,1-2H3.
What are the key properties of 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine?
2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine has a molecular weight of 269.28 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine is sourced from PubChem (CID 82356789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).