4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine

C14H14FNO — CID 84694549

IUPAC4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine
SMILESCC1CNC(c2ccccc2F)c2ccoc21
InChIInChI=1S/C14H14FNO/c1-9-8-16-13(11-6-7-17-14(9)11)10-4-2-3-5-12(10)15/h2-7,9,13,16H,8H2,1H3
InChIKeyHOZKIUYIGJCYEQ-UHFFFAOYSA-N
MW231.27 g/mol
LogP3.21
Rot. Bonds1

About 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine

4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine (PubChem CID 84694549) has the molecular formula C14H14FNO and a molecular weight of 231.27 g/mol. Its IUPAC name is 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine.

Molecular Properties

Compound Name4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine
PubChem CID84694549
Molecular FormulaC14H14FNO
Molecular Weight231.27 g/mol
Exact Mass231.11
IUPAC Name4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine
SMILESCC1CNC(c2ccccc2F)c2ccoc21
InChIInChI=1S/C14H14FNO/c1-9-8-16-13(11-6-7-17-14(9)11)10-4-2-3-5-12(10)15/h2-7,9,13,16H,8H2,1H3
InChIKeyHOZKIUYIGJCYEQ-UHFFFAOYSA-N
XLogP3.21
TPSA25.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.27
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,7-dimethyl-4,5,6,7-tetrahydrofuro[2,3-c]pyridine
CID 13143617
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4-fluoro-2-(2-fluorophenyl)pyrrolidine
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2-(2-fluorophenyl)-3-methyl-5-phenylmorpholine
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(5S)-5-(2-fluorophenyl)-1,3,4,5-tetrahydro-1,4-benzodiazepin-2-one
CID 124510450
(2R,3R,5S)-2-(2-fluorophenyl)-3,4,5-trimethylmorpholine
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(4R)-4-(2-fluorophenyl)-3,3-dimethylpyrrolidine
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(1S,2R,6S)-2-(2-fluorophenyl)-3,4,7-trioxabicyclo[4.1.0]heptane
CID 24797239

Frequently Asked Questions

What is the IUPAC name of 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine?
The IUPAC name of 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine (CID 84694549) is 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine.
What is the SMILES notation for 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine?
The canonical SMILES for 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine is CC1CNC(c2ccccc2F)c2ccoc21.
What is the InChIKey of 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine?
The InChIKey is HOZKIUYIGJCYEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FNO/c1-9-8-16-13(11-6-7-17-14(9)11)10-4-2-3-5-12(10)15/h2-7,9,13,16H,8H2,1H3.
What are the key properties of 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine?
4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine has a molecular weight of 231.27 g/mol, XLogP of 3.21, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluorophenyl)-7-methyl-4,5,6,7-tetrahydrofuro[3,2-c]pyridine is sourced from PubChem (CID 84694549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).