(2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride

C5H10ClNO3 — CID 70246259

IUPAC(2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)[C@@]1(O)CCCN1
InChIInChI=1S/C5H9NO3.ClH/c7-4(8)5(9)2-1-3-6-5;/h6,9H,1-3H2,(H,7,8);1H/t5-;/m0./s1
InChIKeyQLGSWXLHBZHCOR-JEDNCBNOSA-N
MW167.59 g/mol
LogP-0.44
Rot. Bonds1

About (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride

(2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride (PubChem CID 70246259) has the molecular formula C5H10ClNO3 and a molecular weight of 167.59 g/mol. Its IUPAC name is (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name(2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride
PubChem CID70246259
Molecular FormulaC5H10ClNO3
Molecular Weight167.59 g/mol
Exact Mass167.03
IUPAC Name(2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride
SMILESCl.O=C(O)[C@@]1(O)CCCN1
InChIInChI=1S/C5H9NO3.ClH/c7-4(8)5(9)2-1-3-6-5;/h6,9H,1-3H2,(H,7,8);1H/t5-;/m0./s1
InChIKeyQLGSWXLHBZHCOR-JEDNCBNOSA-N
XLogP-0.44
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.59
LogP ≤ 5-0.44
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,3S)-2-amino-3-(hydroxymethyl)pentanoic acid;(2R)-2-hydroxypyrrolidine-2-carboxylic acid
CID 175476813
2-hydroxypiperidine-2-carboxamide
CID 173139070
2-fluoropyrrolidine-2-carboxylic acid
CID 68687263
(2S)-2-formylpyrrolidine-2-carboxylic acid
CID 175746103
2-formylpyrrolidine-2-carboxylic acid
CID 139777637
2-prop-2-ynylpyrrolidine-2-carboxylic acid;hydrochloride
CID 53398204
2-(2-hydroxyphenyl)pyrrolidine-2-carboxylic acid
CID 115103424
(2R)-2-piperidin-1-ylpyrrolidine-2-carboxylic acid
CID 122588259
(2S)-2-prop-1-ynylpyrrolidine-2-carboxylic acid
CID 131000831
methyl (2S)-2-propan-2-ylpyrrolidine-2-carboxylate;hydrochloride
CID 162342607
(2R)-2-benzhydrylpyrrolidine-2-carboxylic acid;hydrochloride
CID 2761924
2-(2,2-dimethylpropyl)pyrrolidine-2-carboxylic acid
CID 115103385

Frequently Asked Questions

What is the IUPAC name of (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride?
The IUPAC name of (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride (CID 70246259) is (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride.
What is the SMILES notation for (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride?
The canonical SMILES for (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride is Cl.O=C(O)[C@@]1(O)CCCN1.
What is the InChIKey of (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride?
The InChIKey is QLGSWXLHBZHCOR-JEDNCBNOSA-N. The full InChI is InChI=1S/C5H9NO3.ClH/c7-4(8)5(9)2-1-3-6-5;/h6,9H,1-3H2,(H,7,8);1H/t5-;/m0./s1.
What are the key properties of (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride?
(2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride has a molecular weight of 167.59 g/mol, XLogP of -0.44, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-hydroxypyrrolidine-2-carboxylic acid;hydrochloride is sourced from PubChem (CID 70246259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).