1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol

C10H12ClFN2O — CID 86720960

IUPAC1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol
SMILESOC1CCN(c2c(F)cncc2Cl)CC1
InChIInChI=1S/C10H12ClFN2O/c11-8-5-13-6-9(12)10(8)14-3-1-7(15)2-4-14/h5-7,15H,1-4H2
InChIKeyXPKZRPUVXGOLGW-UHFFFAOYSA-N
MW230.67 g/mol
LogP1.84
Rot. Bonds1

About 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol

1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol (PubChem CID 86720960) has the molecular formula C10H12ClFN2O and a molecular weight of 230.67 g/mol. Its IUPAC name is 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol.

Molecular Properties

Compound Name1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol
PubChem CID86720960
Molecular FormulaC10H12ClFN2O
Molecular Weight230.67 g/mol
Exact Mass230.06
IUPAC Name1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol
SMILESOC1CCN(c2c(F)cncc2Cl)CC1
InChIInChI=1S/C10H12ClFN2O/c11-8-5-13-6-9(12)10(8)14-3-1-7(15)2-4-14/h5-7,15H,1-4H2
InChIKeyXPKZRPUVXGOLGW-UHFFFAOYSA-N
XLogP1.84
TPSA36.36 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.67
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,5-Dichloro-4-piperidin-1-ylpyridine
CID 101493931
3-[4-(3,5-Dichloro-4-pyridinyl)piperazino]-1,1,1-trifluoro-2-propanol
CID 2738581
1-(3-Chloro-5-fluoro-4-pyridyl)piperazine
CID 86720930
1-(3-Chloro-5-fluoro-4-pyridyl)-4-(oxetan-3-yl)piperazine
CID 86720931
1-(3-Chloro-5-fluoropyridin-4-yl)-4-methylpiperazine
CID 86720933
(S)-1-(3-chloro-5-fluoropyridin-4-yl)-4-(tetrahydrofuran-3-yl)piperazine
CID 86720957
1-(3-Chloro-5-fluoro-4-pyridinyl)-4-(oxolan-3-yl)piperazine
CID 90199333
1-(6-Chloro-5-fluoro-3-pyridinyl)piperidin-4-ol
CID 156153044
4-(2-Chloro-3-fluoro-4-pyridinyl)morpholine
CID 162439764
[1-(2-Chloro-5-fluoro-4-pyridinyl)-4-methylpiperidin-4-yl]methanol
CID 167425458
2-Chloro-5-fluoro-4-piperidin-1-ylpyridine
CID 169928765
(3R,4R)-1-(2-chloro-5-iodo-4-pyridinyl)-4-fluoropiperidin-3-ol
CID 172626910

Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol?
The IUPAC name of 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol (CID 86720960) is 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol.
What is the SMILES notation for 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol?
The canonical SMILES for 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol is OC1CCN(c2c(F)cncc2Cl)CC1.
What is the InChIKey of 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol?
The InChIKey is XPKZRPUVXGOLGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12ClFN2O/c11-8-5-13-6-9(12)10(8)14-3-1-7(15)2-4-14/h5-7,15H,1-4H2.
What are the key properties of 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol?
1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol has a molecular weight of 230.67 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-5-fluoro-4-pyridinyl)piperidin-4-ol is sourced from PubChem (CID 86720960), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).