[(2R)-piperidin-1-ium-2-yl]methanol

C6H14NO+ — CID 6950191

IUPAC[(2R)-piperidin-1-ium-2-yl]methanol
SMILESOC[C@H]1CCCC[NH2+]1
InChIInChI=1S/C6H13NO/c8-5-6-3-1-2-4-7-6/h6-8H,1-5H2/p+1/t6-/m1/s1
InChIKeyPRAYXGYYVXRDDW-ZCFIWIBFSA-O
MW116.18 g/mol
LogP-0.91
Rot. Bonds1

About [(2R)-piperidin-1-ium-2-yl]methanol

[(2R)-piperidin-1-ium-2-yl]methanol (PubChem CID 6950191) has the molecular formula C6H14NO+ and a molecular weight of 116.18 g/mol. Its IUPAC name is [(2R)-piperidin-1-ium-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-piperidin-1-ium-2-yl]methanol
PubChem CID6950191
Molecular FormulaC6H14NO+
Molecular Weight116.18 g/mol
Exact Mass116.11
IUPAC Name[(2R)-piperidin-1-ium-2-yl]methanol
SMILESOC[C@H]1CCCC[NH2+]1
InChIInChI=1S/C6H13NO/c8-5-6-3-1-2-4-7-6/h6-8H,1-5H2/p+1/t6-/m1/s1
InChIKeyPRAYXGYYVXRDDW-ZCFIWIBFSA-O
XLogP-0.91
TPSA36.84 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.18
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

2-Piperidin-2-ylethanol
CID 15144
1-(Piperidin-2-yl)propan-1-ol
CID 10314
Piperidin-2-ylmethanol
CID 94263
(2s,3r)-2-(Hydroxymethyl)piperidin-3-ol
CID 14659558
Conhydrine
CID 11744748
1-Methyl-2-piperidinemethanol
CID 89394
1-(Piperidin-2-yl)ethan-1-ol
CID 335682
(3R,6S)-6-hydroxymethylpiperidin-3-ol
CID 11062425
((2S)-piperidin-2-yl)methanol
CID 6950194
rac-(3R,6R)-6-methylpiperidin-3-ol
CID 58398985
(2-Methylpiperidin-2-yl)methanol
CID 56776523
(3S,6S)-6-methylpiperidin-3-ol
CID 55287016

Frequently Asked Questions

What is the IUPAC name of [(2R)-piperidin-1-ium-2-yl]methanol?
The IUPAC name of [(2R)-piperidin-1-ium-2-yl]methanol (CID 6950191) is [(2R)-piperidin-1-ium-2-yl]methanol.
What is the SMILES notation for [(2R)-piperidin-1-ium-2-yl]methanol?
The canonical SMILES for [(2R)-piperidin-1-ium-2-yl]methanol is OC[C@H]1CCCC[NH2+]1.
What is the InChIKey of [(2R)-piperidin-1-ium-2-yl]methanol?
The InChIKey is PRAYXGYYVXRDDW-ZCFIWIBFSA-O. The full InChI is InChI=1S/C6H13NO/c8-5-6-3-1-2-4-7-6/h6-8H,1-5H2/p+1/t6-/m1/s1.
What are the key properties of [(2R)-piperidin-1-ium-2-yl]methanol?
[(2R)-piperidin-1-ium-2-yl]methanol has a molecular weight of 116.18 g/mol, XLogP of -0.91, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-piperidin-1-ium-2-yl]methanol is sourced from PubChem (CID 6950191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).