9-(fluoromethyl)-4H-quinolizine

C10H10FN — CID 88500987

IUPAC9-(fluoromethyl)-4H-quinolizine
SMILESFCC1=CC=CN2CC=CC=C12
InChIInChI=1S/C10H10FN/c11-8-9-4-3-7-12-6-2-1-5-10(9)12/h1-5,7H,6,8H2
InChIKeyZQCBDWJIXPFTSC-UHFFFAOYSA-N
MW163.19 g/mol
LogP2.17
Rot. Bonds1

About 9-(fluoromethyl)-4H-quinolizine

9-(fluoromethyl)-4H-quinolizine (PubChem CID 88500987) has the molecular formula C10H10FN and a molecular weight of 163.19 g/mol. Its IUPAC name is 9-(fluoromethyl)-4H-quinolizine.

Molecular Properties

Compound Name9-(fluoromethyl)-4H-quinolizine
PubChem CID88500987
Molecular FormulaC10H10FN
Molecular Weight163.19 g/mol
Exact Mass163.08
IUPAC Name9-(fluoromethyl)-4H-quinolizine
SMILESFCC1=CC=CN2CC=CC=C12
InChIInChI=1S/C10H10FN/c11-8-9-4-3-7-12-6-2-1-5-10(9)12/h1-5,7H,6,8H2
InChIKeyZQCBDWJIXPFTSC-UHFFFAOYSA-N
XLogP2.17
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.19
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 9-(fluoromethyl)-4H-quinolizine?
The IUPAC name of 9-(fluoromethyl)-4H-quinolizine (CID 88500987) is 9-(fluoromethyl)-4H-quinolizine.
What is the SMILES notation for 9-(fluoromethyl)-4H-quinolizine?
The canonical SMILES for 9-(fluoromethyl)-4H-quinolizine is FCC1=CC=CN2CC=CC=C12.
What is the InChIKey of 9-(fluoromethyl)-4H-quinolizine?
The InChIKey is ZQCBDWJIXPFTSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN/c11-8-9-4-3-7-12-6-2-1-5-10(9)12/h1-5,7H,6,8H2.
What are the key properties of 9-(fluoromethyl)-4H-quinolizine?
9-(fluoromethyl)-4H-quinolizine has a molecular weight of 163.19 g/mol, XLogP of 2.17, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(fluoromethyl)-4H-quinolizine is sourced from PubChem (CID 88500987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).