(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride

C5H14Cl2N2O — CID 154804814

IUPAC(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride
SMILESCl.Cl.N[C@@H]1CCNC[C@H]1O
InChIInChI=1S/C5H12N2O.2ClH/c6-4-1-2-7-3-5(4)8;;/h4-5,7-8H,1-3,6H2;2*1H/t4-,5-;;/m1../s1
InChIKeyTXJUMWIOLHLXPY-ALUAXPQUSA-N
MW189.09 g/mol
LogP-0.49
Rot. Bonds

About (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride

(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride (PubChem CID 154804814) has the molecular formula C5H14Cl2N2O and a molecular weight of 189.09 g/mol. Its IUPAC name is (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride.

Molecular Properties

Compound Name(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride
PubChem CID154804814
Molecular FormulaC5H14Cl2N2O
Molecular Weight189.09 g/mol
Exact Mass188.05
IUPAC Name(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride
SMILESCl.Cl.N[C@@H]1CCNC[C@H]1O
InChIInChI=1S/C5H12N2O.2ClH/c6-4-1-2-7-3-5(4)8;;/h4-5,7-8H,1-3,6H2;2*1H/t4-,5-;;/m1../s1
InChIKeyTXJUMWIOLHLXPY-ALUAXPQUSA-N
XLogP-0.49
TPSA58.28 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.09
LogP ≤ 5-0.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

4-aminopiperidin-3-ol
CID 54373786
(3S,4S)-3-aminopiperidin-4-ol;dihydrochloride
CID 171370179
(6S,7S)-7-amino-1,4-diazocan-6-ol
CID 59071597
(3R)-3-aminopiperidin-4-ol
CID 52917019
(3S,4S)-4-ethylpiperidin-3-ol
CID 96732602
(3R,4R)-4-aminopyrrolidin-3-ol
CID 10725920
3-[(3S,4R)-3-hydroxypiperidin-4-yl]propanoic acid;hydrochloride
CID 141050342
4-prop-2-enylpiperidin-3-ol
CID 89139617
(3R,4S)-4-benzylpiperidin-3-ol;hydrochloride
CID 171688498
3-methylpiperidin-4-amine;dihydrochloride
CID 155921065
(3R,4S)-3-fluoropiperidin-4-amine;hydrochloride
CID 170923054
(3S,4S)-4-(dimethylamino)piperidin-3-ol;hydrochloride
CID 156592163

Frequently Asked Questions

What is the IUPAC name of (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride?
The IUPAC name of (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride (CID 154804814) is (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride.
What is the SMILES notation for (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride?
The canonical SMILES for (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride is Cl.Cl.N[C@@H]1CCNC[C@H]1O.
What is the InChIKey of (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride?
The InChIKey is TXJUMWIOLHLXPY-ALUAXPQUSA-N. The full InChI is InChI=1S/C5H12N2O.2ClH/c6-4-1-2-7-3-5(4)8;;/h4-5,7-8H,1-3,6H2;2*1H/t4-,5-;;/m1../s1.
What are the key properties of (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride?
(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride has a molecular weight of 189.09 g/mol, XLogP of -0.49, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R,4R)-4-aminopiperidin-3-ol;dihydrochloride is sourced from PubChem (CID 154804814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).