6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine

C16H14FN3O2 — CID 82356752

IUPAC6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine
SMILESCCCOc1ccc(-c2nc3ccc(F)cn3c2N=O)cc1
InChIInChI=1S/C16H14FN3O2/c1-2-9-22-13-6-3-11(4-7-13)15-16(19-21)20-10-12(17)5-8-14(20)18-15/h3-8,10H,2,9H2,1H3
InChIKeyAYKCTGHWNGULET-UHFFFAOYSA-N
MW299.31 g/mol
LogP4.33
Rot. Bonds5

About 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine

6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine (PubChem CID 82356752) has the molecular formula C16H14FN3O2 and a molecular weight of 299.31 g/mol. Its IUPAC name is 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine
PubChem CID82356752
Molecular FormulaC16H14FN3O2
Molecular Weight299.31 g/mol
Exact Mass299.11
IUPAC Name6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine
SMILESCCCOc1ccc(-c2nc3ccc(F)cn3c2N=O)cc1
InChIInChI=1S/C16H14FN3O2/c1-2-9-22-13-6-3-11(4-7-13)15-16(19-21)20-10-12(17)5-8-14(20)18-15/h3-8,10H,2,9H2,1H3
InChIKeyAYKCTGHWNGULET-UHFFFAOYSA-N
XLogP4.33
TPSA55.96 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.31
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-methyl-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine
CID 82356422
6-fluoro-2-(4-nitrophenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356743
6-fluoro-2-(4-methoxy-3-methylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356749
2-(4-fluorophenyl)-3-nitroso-6-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 95967166
2-[2-(4-ethoxyphenyl)-6-fluoroimidazo[1,2-a]pyridin-3-yl]acetonitrile
CID 82060561
[2-(4-ethylphenyl)-3-nitrosoimidazo[1,2-a]pyridin-6-yl]methanol
CID 82356696
2-(2,4-dimethylphenyl)-6-fluoro-3-nitrosoimidazo[1,2-a]pyridine
CID 82356789
ethyl 6-fluoro-3-nitrosoimidazo[1,2-a]pyridine-2-carboxylate
CID 82356768
6-chloro-2-(4-fluoro-3-methylphenyl)-3-nitrosoimidazo[1,2-a]pyridine
CID 82356825
2-[6-fluoro-2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]acetic acid
CID 82060605
2-[4-[6-bromo-3-(4-fluoroanilino)imidazo[1,2-a]pyridin-2-yl]phenoxy]ethanol
CID 71596174
[3-methyl-2-(4-propoxyphenyl)imidazo[1,2-a]pyridin-7-yl]methanamine
CID 82059872

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine (CID 82356752) is 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine is CCCOc1ccc(-c2nc3ccc(F)cn3c2N=O)cc1.
What is the InChIKey of 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine?
The InChIKey is AYKCTGHWNGULET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14FN3O2/c1-2-9-22-13-6-3-11(4-7-13)15-16(19-21)20-10-12(17)5-8-14(20)18-15/h3-8,10H,2,9H2,1H3.
What are the key properties of 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine?
6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine has a molecular weight of 299.31 g/mol, XLogP of 4.33, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-nitroso-2-(4-propoxyphenyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 82356752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).