6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine

C15H11FN2O3 — CID 157017620

IUPAC6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine
SMILESCOc1cc2c(cc1-c1cnc3ccc(F)cn13)OCO2
InChIInChI=1S/C15H11FN2O3/c1-19-12-5-14-13(20-8-21-14)4-10(12)11-6-17-15-3-2-9(16)7-18(11)15/h2-7H,8H2,1H3
InChIKeyFXFDDKNYPWEZKP-UHFFFAOYSA-N
MW286.26 g/mol
LogP2.88
Rot. Bonds2

About 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine

6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine (PubChem CID 157017620) has the molecular formula C15H11FN2O3 and a molecular weight of 286.26 g/mol. Its IUPAC name is 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine
PubChem CID157017620
Molecular FormulaC15H11FN2O3
Molecular Weight286.26 g/mol
Exact Mass286.08
IUPAC Name6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine
SMILESCOc1cc2c(cc1-c1cnc3ccc(F)cn13)OCO2
InChIInChI=1S/C15H11FN2O3/c1-19-12-5-14-13(20-8-21-14)4-10(12)11-6-17-15-3-2-9(16)7-18(11)15/h2-7H,8H2,1H3
InChIKeyFXFDDKNYPWEZKP-UHFFFAOYSA-N
XLogP2.88
TPSA44.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.26
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

5-(6-methoxy-1,3-benzodioxol-5-yl)-1-methylpyrazole
CID 162636292
3-fluoro-4-(6-methoxy-1,3-benzodioxol-5-yl)pyridine
CID 163311853
5-(6-methoxy-1,3-benzodioxol-5-yl)pyrimidin-2-amine
CID 163307237
3-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-2-hydroxybenzaldehyde
CID 175903594
3-(6-methoxy-1,3-benzodioxol-5-yl)pyridin-4-amine
CID 162632386
3-(3,4-dimethoxyphenyl)-6-[5-(4-fluorophenyl)-1H-pyrazol-4-yl]imidazo[1,2-a]pyridine;dihydrochloride
CID 22031264
6-[4-(6-methoxy-1,3-benzodioxol-5-yl)phenoxy]pyridin-3-amine
CID 162632824
2-(6-methoxy-1,3-benzodioxol-5-yl)-1-propan-2-ylimidazole
CID 162638690
6-fluoro-3-[4-[2-(oxan-4-yloxy)ethoxy]phenyl]imidazo[1,2-a]pyridine
CID 71242959
1,3-benzodioxol-5-ylmethyl-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]azanium
CID 7248527
2-(6-methoxy-1,3-benzodioxol-5-yl)-7-methylpurine
CID 157013233
5-(6-methoxy-1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-amine
CID 163306861

Frequently Asked Questions

What is the IUPAC name of 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine (CID 157017620) is 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine is COc1cc2c(cc1-c1cnc3ccc(F)cn13)OCO2.
What is the InChIKey of 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine?
The InChIKey is FXFDDKNYPWEZKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11FN2O3/c1-19-12-5-14-13(20-8-21-14)4-10(12)11-6-17-15-3-2-9(16)7-18(11)15/h2-7H,8H2,1H3.
What are the key properties of 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine?
6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine has a molecular weight of 286.26 g/mol, XLogP of 2.88, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-3-(6-methoxy-1,3-benzodioxol-5-yl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 157017620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).