methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate

C15H10FNO3 — CID 162519491

IUPACmethyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate
SMILESCOC(=O)c1ccc(-c2nccc3occc23)cc1F
InChIInChI=1S/C15H10FNO3/c1-19-15(18)10-3-2-9(8-12(10)16)14-11-5-7-20-13(11)4-6-17-14/h2-8H,1H3
InChIKeyCJURAZIEBAJDPT-UHFFFAOYSA-N
MW271.25 g/mol
LogP3.42
Rot. Bonds2

About methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate

methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate (PubChem CID 162519491) has the molecular formula C15H10FNO3 and a molecular weight of 271.25 g/mol. Its IUPAC name is methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate.

Molecular Properties

Compound Namemethyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate
PubChem CID162519491
Molecular FormulaC15H10FNO3
Molecular Weight271.25 g/mol
Exact Mass271.06
IUPAC Namemethyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate
SMILESCOC(=O)c1ccc(-c2nccc3occc23)cc1F
InChIInChI=1S/C15H10FNO3/c1-19-15(18)10-3-2-9(8-12(10)16)14-11-5-7-20-13(11)4-6-17-14/h2-8H,1H3
InChIKeyCJURAZIEBAJDPT-UHFFFAOYSA-N
XLogP3.42
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 53.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

4-[3-(4-Fluorophenyl)furo[3,2-b]pyridin-2-yl]pyridine
CID 10935149
1-{1-[2-(4-Fluoro-phenoxy)-ethyl]-1H-indol-3-yl}-ethanone
CID 1088558
Furo[3,2-c]pyridine
CID 12234604
4-(2-Benzofuranyl)pyridine
CID 65590
methyl 1-(2-phenoxyethyl)-1H-indole-3-carboxylate
CID 951764
4-(3-{4-[1-(4-Propyl-phenoxy)-ethyl]-benzoyl}-indol-1-yl)-butyric acid
CID 44275112
2-{[5-(2-Furyl)pyridin-3-yl]ethynyl}-6-methylpyridine
CID 44392451
11-Methylfuro[3,2-c][1,10]phenanthroline
CID 44587501
3-[(5E)-5-(1-benzofuran-3-ylmethylidene)-3,4-dihydro-2H-pyridin-6-yl]pyridine
CID 46837513
3-[4-[[2-(3,5-Dimethyl-1,2-oxazol-4-yl)-4-pyridinyl]methoxy]-2-fluorophenyl]propanoic acid
CID 127046667
2-(Furan-3-yl)-5-[(5-methyl-3-pyridinyl)methyl]pyridine
CID 137650545
1-[2-(2-fluorophenoxy)ethyl]-1H-indole-3-carbaldehyde
CID 675069

Frequently Asked Questions

What is the IUPAC name of methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate?
The IUPAC name of methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate (CID 162519491) is methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate.
What is the SMILES notation for methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate?
The canonical SMILES for methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate is COC(=O)c1ccc(-c2nccc3occc23)cc1F.
What is the InChIKey of methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate?
The InChIKey is CJURAZIEBAJDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10FNO3/c1-19-15(18)10-3-2-9(8-12(10)16)14-11-5-7-20-13(11)4-6-17-14/h2-8H,1H3.
What are the key properties of methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate?
methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate has a molecular weight of 271.25 g/mol, XLogP of 3.42, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-fluoro-4-furo[3,2-c]pyridin-4-ylbenzoate is sourced from PubChem (CID 162519491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).