(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol

C8H16FNO — CID 171842824

IUPAC(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol
SMILESC[C@](F)(CO)[C@H]1CCCNC1
InChIInChI=1S/C8H16FNO/c1-8(9,6-11)7-3-2-4-10-5-7/h7,10-11H,2-6H2,1H3/t7-,8-/m0/s1
InChIKeyQTJWBLDSLHJSJQ-YUMQZZPRSA-N
MW161.22 g/mol
LogP0.71
Rot. Bonds2

About (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol

(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol (PubChem CID 171842824) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol.

Molecular Properties

Compound Name(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol
PubChem CID171842824
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol
SMILESC[C@](F)(CO)[C@H]1CCCNC1
InChIInChI=1S/C8H16FNO/c1-8(9,6-11)7-3-2-4-10-5-7/h7,10-11H,2-6H2,1H3/t7-,8-/m0/s1
InChIKeyQTJWBLDSLHJSJQ-YUMQZZPRSA-N
XLogP0.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-2-piperidin-3-ylpropan-1-amine
CID 105431462
2-methyl-2-piperidin-3-ylpropan-1-ol
CID 83200214
(2S)-2-[(3R)-piperidin-3-yl]propane-1,2-diol
CID 171842996
3-(2-fluoro-1-methoxypropan-2-yl)piperidine
CID 112564846
3-(4-ethyl-2-fluorohexan-2-yl)piperidine
CID 112564814
3-(2-fluoro-1-phenylpropan-2-yl)piperidine
CID 83853692
3-(1-cyclopropyl-1-fluoroethyl)piperidine
CID 112564879
(3R)-3-tert-butylpiperidine
CID 59772800
2-piperidin-3-ylbutan-2-ol
CID 63586087
3-[2-fluoro-1-(4-methylphenyl)propan-2-yl]piperidine
CID 112564824
2-piperidin-3-ylpentan-2-ol
CID 63586269
5,5-dimethyl-2-piperidin-3-ylhexan-2-ol
CID 65146059

Frequently Asked Questions

What is the IUPAC name of (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol?
The IUPAC name of (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol (CID 171842824) is (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol.
What is the SMILES notation for (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol?
The canonical SMILES for (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol is C[C@](F)(CO)[C@H]1CCCNC1.
What is the InChIKey of (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol?
The InChIKey is QTJWBLDSLHJSJQ-YUMQZZPRSA-N. The full InChI is InChI=1S/C8H16FNO/c1-8(9,6-11)7-3-2-4-10-5-7/h7,10-11H,2-6H2,1H3/t7-,8-/m0/s1.
What are the key properties of (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol?
(2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol has a molecular weight of 161.22 g/mol, XLogP of 0.71, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-fluoro-2-[(3S)-piperidin-3-yl]propan-1-ol is sourced from PubChem (CID 171842824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).