7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline

C13H12FNO — CID 172605667

IUPAC7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline
SMILESCc1nc2cc(CF)ccc2c2c1COC2
InChIInChI=1S/C13H12FNO/c1-8-11-6-16-7-12(11)10-3-2-9(5-14)4-13(10)15-8/h2-4H,5-7H2,1H3
InChIKeyWVVUFJSCHZRFGB-UHFFFAOYSA-N
MW217.24 g/mol
LogP3.04
Rot. Bonds1

About 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline

7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline (PubChem CID 172605667) has the molecular formula C13H12FNO and a molecular weight of 217.24 g/mol. Its IUPAC name is 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline.

Molecular Properties

Compound Name7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline
PubChem CID172605667
Molecular FormulaC13H12FNO
Molecular Weight217.24 g/mol
Exact Mass217.09
IUPAC Name7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline
SMILESCc1nc2cc(CF)ccc2c2c1COC2
InChIInChI=1S/C13H12FNO/c1-8-11-6-16-7-12(11)10-3-2-9(5-14)4-13(10)15-8/h2-4H,5-7H2,1H3
InChIKeyWVVUFJSCHZRFGB-UHFFFAOYSA-N
XLogP3.04
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.24
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline?
The IUPAC name of 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline (CID 172605667) is 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline.
What is the SMILES notation for 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline?
The canonical SMILES for 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline is Cc1nc2cc(CF)ccc2c2c1COC2.
What is the InChIKey of 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline?
The InChIKey is WVVUFJSCHZRFGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12FNO/c1-8-11-6-16-7-12(11)10-3-2-9(5-14)4-13(10)15-8/h2-4H,5-7H2,1H3.
What are the key properties of 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline?
7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline has a molecular weight of 217.24 g/mol, XLogP of 3.04, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(fluoromethyl)-4-methyl-1,3-dihydrofuro[3,4-c]quinoline is sourced from PubChem (CID 172605667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).