3-(4-fluoropiperidin-4-yl)-5-propoxypyridine

C13H19FN2O — CID 112563225

IUPAC3-(4-fluoropiperidin-4-yl)-5-propoxypyridine
SMILESCCCOc1cncc(C2(F)CCNCC2)c1
InChIInChI=1S/C13H19FN2O/c1-2-7-17-12-8-11(9-16-10-12)13(14)3-5-15-6-4-13/h8-10,15H,2-7H2,1H3
InChIKeyQIFAGOBGYSXAJZ-UHFFFAOYSA-N
MW238.31 g/mol
LogP2.42
Rot. Bonds4

About 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine

3-(4-fluoropiperidin-4-yl)-5-propoxypyridine (PubChem CID 112563225) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine.

Molecular Properties

Compound Name3-(4-fluoropiperidin-4-yl)-5-propoxypyridine
PubChem CID112563225
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC Name3-(4-fluoropiperidin-4-yl)-5-propoxypyridine
SMILESCCCOc1cncc(C2(F)CCNCC2)c1
InChIInChI=1S/C13H19FN2O/c1-2-7-17-12-8-11(9-16-10-12)13(14)3-5-15-6-4-13/h8-10,15H,2-7H2,1H3
InChIKeyQIFAGOBGYSXAJZ-UHFFFAOYSA-N
XLogP2.42
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine with MolForge

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

Launch Full Analysis

Related Compounds

3-(3-fluoroazetidin-3-yl)-5-propoxypyridine
CID 112563519
3-fluoro-3-(4-propoxyphenyl)piperidine
CID 112562960
(4,4-difluorocyclohexyl)-(5-propoxy-3-pyridinyl)methanone
CID 105124282
1-(5-butoxy-3-pyridinyl)piperazine
CID 22478494
(5-ethoxy-3-pyridinyl)-(4-ethylpiperidin-4-yl)methanone
CID 116568171
1-(5-butoxy-3-pyridinyl)-1,5-diazocane
CID 11494630
2-ethyl-1-(5-propoxy-3-pyridinyl)butane-1,2-diol
CID 103449515
5-fluoro-6-(5-propoxy-3-pyridinyl)-1H-pyrimidine-2-thione
CID 106520729
1-benzyl-3-(5-propoxy-3-pyridinyl)piperidin-3-ol
CID 113341056
4-(6-propoxy-3-pyridinyl)piperidin-4-ol
CID 69450972
2,2,2-trifluoro-N-methyl-1-(5-propoxy-3-pyridinyl)ethanamine
CID 105026955
N-methyl-1-(1-methylcyclopentyl)-1-(5-propoxy-3-pyridinyl)methanamine
CID 105026977

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine?
The IUPAC name of 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine (CID 112563225) is 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine.
What is the SMILES notation for 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine?
The canonical SMILES for 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine is CCCOc1cncc(C2(F)CCNCC2)c1.
What is the InChIKey of 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine?
The InChIKey is QIFAGOBGYSXAJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-2-7-17-12-8-11(9-16-10-12)13(14)3-5-15-6-4-13/h8-10,15H,2-7H2,1H3.
What are the key properties of 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine?
3-(4-fluoropiperidin-4-yl)-5-propoxypyridine has a molecular weight of 238.31 g/mol, XLogP of 2.42, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoropiperidin-4-yl)-5-propoxypyridine is sourced from PubChem (CID 112563225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).