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

C5H14Cl2N2O — CID 171370179

IUPAC(3S,4S)-3-aminopiperidin-4-ol;dihydrochloride
SMILESCl.Cl.N[C@H]1CNCC[C@@H]1O
InChIInChI=1S/C5H12N2O.2ClH/c6-4-3-7-2-1-5(4)8;;/h4-5,7-8H,1-3,6H2;2*1H/t4-,5-;;/m0../s1
InChIKeySJLRDSYIJUETQL-RSLHMRQOSA-N
MW189.09 g/mol
LogP-0.49
Rot. Bonds

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

(3S,4S)-3-aminopiperidin-4-ol;dihydrochloride (PubChem CID 171370179) has the molecular formula C5H14Cl2N2O and a molecular weight of 189.09 g/mol. Its IUPAC name is (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride.

Molecular Properties

Compound Name(3S,4S)-3-aminopiperidin-4-ol;dihydrochloride
PubChem CID171370179
Molecular FormulaC5H14Cl2N2O
Molecular Weight189.09 g/mol
Exact Mass188.05
IUPAC Name(3S,4S)-3-aminopiperidin-4-ol;dihydrochloride
SMILESCl.Cl.N[C@H]1CNCC[C@@H]1O
InChIInChI=1S/C5H12N2O.2ClH/c6-4-3-7-2-1-5(4)8;;/h4-5,7-8H,1-3,6H2;2*1H/t4-,5-;;/m0../s1
InChIKeySJLRDSYIJUETQL-RSLHMRQOSA-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

Analyze (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride 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

(3R)-3-aminopiperidin-4-ol
CID 52917019
(3R,4R)-4-aminopiperidin-3-ol;dihydrochloride
CID 154804814
(6S,7S)-7-amino-1,4-diazocan-6-ol
CID 59071597
4-aminopiperidin-3-ol
CID 54373786
(3R,4R)-4-aminopyrrolidin-3-ol
CID 10725920
(3S,4R)-3-methylpiperidin-4-ol;hydrochloride
CID 69092530
3-aminopiperidin-4-ol;benzyl carbonochloridate
CID 175289622
(3R)-4-cyclopropylpiperidin-3-amine;dihydrochloride
CID 76844694
CID 58592953
CID 58592953
(3S,4R)-4-fluoropiperidin-3-amine
CID 97053659
(3S,4S)-3-(cyclopropylmethyl)piperidin-4-ol
CID 129393768
4-hydroxypiperidine-3-carboxamide
CID 146446982

Frequently Asked Questions

What is the IUPAC name of (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride?
The IUPAC name of (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride (CID 171370179) is (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride.
What is the SMILES notation for (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride?
The canonical SMILES for (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride is Cl.Cl.N[C@H]1CNCC[C@@H]1O.
What is the InChIKey of (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride?
The InChIKey is SJLRDSYIJUETQL-RSLHMRQOSA-N. The full InChI is InChI=1S/C5H12N2O.2ClH/c6-4-3-7-2-1-5(4)8;;/h4-5,7-8H,1-3,6H2;2*1H/t4-,5-;;/m0../s1.
What are the key properties of (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride?
(3S,4S)-3-aminopiperidin-4-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 (3S,4S)-3-aminopiperidin-4-ol;dihydrochloride is sourced from PubChem (CID 171370179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).