2-hydroxypiperidine-1-carboxylic acid;hydrochloride

C6H12ClNO3 — CID 178068462

IUPAC2-hydroxypiperidine-1-carboxylic acid;hydrochloride
SMILESCl.O=C(O)N1CCCCC1O
InChIInChI=1S/C6H11NO3.ClH/c8-5-3-1-2-4-7(5)6(9)10;/h5,8H,1-4H2,(H,9,10);1H
InChIKeyHPMNCKUASDHKKU-UHFFFAOYSA-N
MW181.62 g/mol
LogP0.89
Rot. Bonds

About 2-hydroxypiperidine-1-carboxylic acid;hydrochloride

2-hydroxypiperidine-1-carboxylic acid;hydrochloride (PubChem CID 178068462) has the molecular formula C6H12ClNO3 and a molecular weight of 181.62 g/mol. Its IUPAC name is 2-hydroxypiperidine-1-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name2-hydroxypiperidine-1-carboxylic acid;hydrochloride
PubChem CID178068462
Molecular FormulaC6H12ClNO3
Molecular Weight181.62 g/mol
Exact Mass181.05
IUPAC Name2-hydroxypiperidine-1-carboxylic acid;hydrochloride
SMILESCl.O=C(O)N1CCCCC1O
InChIInChI=1S/C6H11NO3.ClH/c8-5-3-1-2-4-7(5)6(9)10;/h5,8H,1-4H2,(H,9,10);1H
InChIKeyHPMNCKUASDHKKU-UHFFFAOYSA-N
XLogP0.89
TPSA60.77 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.62
LogP ≤ 50.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxypiperidine-1-carboxylic acid;hydrochloride?
The IUPAC name of 2-hydroxypiperidine-1-carboxylic acid;hydrochloride (CID 178068462) is 2-hydroxypiperidine-1-carboxylic acid;hydrochloride.
What is the SMILES notation for 2-hydroxypiperidine-1-carboxylic acid;hydrochloride?
The canonical SMILES for 2-hydroxypiperidine-1-carboxylic acid;hydrochloride is Cl.O=C(O)N1CCCCC1O.
What is the InChIKey of 2-hydroxypiperidine-1-carboxylic acid;hydrochloride?
The InChIKey is HPMNCKUASDHKKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO3.ClH/c8-5-3-1-2-4-7(5)6(9)10;/h5,8H,1-4H2,(H,9,10);1H.
What are the key properties of 2-hydroxypiperidine-1-carboxylic acid;hydrochloride?
2-hydroxypiperidine-1-carboxylic acid;hydrochloride has a molecular weight of 181.62 g/mol, XLogP of 0.89, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypiperidine-1-carboxylic acid;hydrochloride is sourced from PubChem (CID 178068462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).