6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline

C19H18FN3 — CID 175995097

IUPAC6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline
SMILESFc1cc(-c2ccc3nc(N4CCCCC4)ccc3c2)ccn1
InChIInChI=1S/C19H18FN3/c20-18-13-15(8-9-21-18)14-4-6-17-16(12-14)5-7-19(22-17)23-10-2-1-3-11-23/h4-9,12-13H,1-3,10-11H2
InChIKeyDXCDWOSJFDNZFO-UHFFFAOYSA-N
MW307.37 g/mol
LogP4.43
Rot. Bonds2

About 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline

6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline (PubChem CID 175995097) has the molecular formula C19H18FN3 and a molecular weight of 307.37 g/mol. Its IUPAC name is 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline.

Molecular Properties

Compound Name6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline
PubChem CID175995097
Molecular FormulaC19H18FN3
Molecular Weight307.37 g/mol
Exact Mass307.15
IUPAC Name6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline
SMILESFc1cc(-c2ccc3nc(N4CCCCC4)ccc3c2)ccn1
InChIInChI=1S/C19H18FN3/c20-18-13-15(8-9-21-18)14-4-6-17-16(12-14)5-7-19(22-17)23-10-2-1-3-11-23/h4-9,12-13H,1-3,10-11H2
InChIKeyDXCDWOSJFDNZFO-UHFFFAOYSA-N
XLogP4.43
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.37
LogP ≤ 54.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline?
The IUPAC name of 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline (CID 175995097) is 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline.
What is the SMILES notation for 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline?
The canonical SMILES for 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline is Fc1cc(-c2ccc3nc(N4CCCCC4)ccc3c2)ccn1.
What is the InChIKey of 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline?
The InChIKey is DXCDWOSJFDNZFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3/c20-18-13-15(8-9-21-18)14-4-6-17-16(12-14)5-7-19(22-17)23-10-2-1-3-11-23/h4-9,12-13H,1-3,10-11H2.
What are the key properties of 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline?
6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline has a molecular weight of 307.37 g/mol, XLogP of 4.43, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-fluoro-4-pyridinyl)-2-piperidin-1-ylquinoline is sourced from PubChem (CID 175995097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).