methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate

C12H10FNO3 — CID 178038953

IUPACmethyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate
SMILESCOC(=O)c1cncc2cc(C3(F)CC3)oc12
InChIInChI=1S/C12H10FNO3/c1-16-11(15)8-6-14-5-7-4-9(17-10(7)8)12(13)2-3-12/h4-6H,2-3H2,1H3
InChIKeyPEVSBLAYBLSVDA-UHFFFAOYSA-N
MW235.21 g/mol
LogP2.57
Rot. Bonds2

About methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate

methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate (PubChem CID 178038953) has the molecular formula C12H10FNO3 and a molecular weight of 235.21 g/mol. Its IUPAC name is methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate.

Molecular Properties

Compound Namemethyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate
PubChem CID178038953
Molecular FormulaC12H10FNO3
Molecular Weight235.21 g/mol
Exact Mass235.06
IUPAC Namemethyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate
SMILESCOC(=O)c1cncc2cc(C3(F)CC3)oc12
InChIInChI=1S/C12H10FNO3/c1-16-11(15)8-6-14-5-7-4-9(17-10(7)8)12(13)2-3-12/h4-6H,2-3H2,1H3
InChIKeyPEVSBLAYBLSVDA-UHFFFAOYSA-N
XLogP2.57
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.21
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methoxy-5-[2-(2-methoxyphenyl)-1-benzofuran-3-yl]pyridine
CID 44142386
2-Methylfuro[3,2-c]pyridine
CID 13803064
2-[3-(Trifluoromethyl)phenyl]furo[3,2-c]pyridine
CID 5049727
2-(3-Fluoro-methylphenyl)furo[3,2-c]pyridine
CID 129693325
4-Ethoxyfuro[3,2-c]pyridine
CID 12378890
7-Iodo-2-phenylfuro[3,2-c]pyridine
CID 21816977
3-(1-Benzofuran-2-YL)pyridine
CID 21856044
7-Phenylfuro[3,4-c]pyridine
CID 57057796
4-Methylbenzofuro[3,2-c]pyridine
CID 117732578
1-Benzofuran-3-yl-(2-fluoro-3-pyridinyl)methanone
CID 22612315
2-Fluoro-5-(5-methylfuran-2-yl)pyridine
CID 57834000
Ethyl 3-[2-[[3-(trifluoromethyl)phenyl]methyl]furo[3,2-c]pyridin-4-yl]benzoate
CID 67184883

Frequently Asked Questions

What is the IUPAC name of methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate?
The IUPAC name of methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate (CID 178038953) is methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate.
What is the SMILES notation for methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate?
The canonical SMILES for methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate is COC(=O)c1cncc2cc(C3(F)CC3)oc12.
What is the InChIKey of methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate?
The InChIKey is PEVSBLAYBLSVDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FNO3/c1-16-11(15)8-6-14-5-7-4-9(17-10(7)8)12(13)2-3-12/h4-6H,2-3H2,1H3.
What are the key properties of methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate?
methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate has a molecular weight of 235.21 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 2-(1-fluorocyclopropyl)furo[3,2-c]pyridine-7-carboxylate is sourced from PubChem (CID 178038953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).