(2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid

C10H18N2O6 — CID 157188043

IUPAC(2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid
SMILESO=C(O)[C@@H]1CC(O)CN1.O=C(O)[C@@H]1CCC(O)N1
InChIInChI=1S/2C5H9NO3/c7-3-1-4(5(8)9)6-2-3;7-4-2-1-3(6-4)5(8)9/h2*3-4,6-7H,1-2H2,(H,8,9)/t3?,4-;3-,4?/m00/s1
InChIKeyAPIXUMPSQOVBBC-BUBOGGHKSA-N
MW262.26 g/mol
LogP-2.06
Rot. Bonds2

About (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid

(2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid (PubChem CID 157188043) has the molecular formula C10H18N2O6 and a molecular weight of 262.26 g/mol. Its IUPAC name is (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid
PubChem CID157188043
Molecular FormulaC10H18N2O6
Molecular Weight262.26 g/mol
Exact Mass262.12
IUPAC Name(2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid
SMILESO=C(O)[C@@H]1CC(O)CN1.O=C(O)[C@@H]1CCC(O)N1
InChIInChI=1S/2C5H9NO3/c7-3-1-4(5(8)9)6-2-3;7-4-2-1-3(6-4)5(8)9/h2*3-4,6-7H,1-2H2,(H,8,9)/t3?,4-;3-,4?/m00/s1
InChIKeyAPIXUMPSQOVBBC-BUBOGGHKSA-N
XLogP-2.06
TPSA139.12 Ų
H-Bond Donors6
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500262.26
LogP ≤ 5-2.06
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 106

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Related Compounds

(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydrochloride
CID 11205991
(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;hydroxysilane
CID 131716757
bis((2S,5S)-5-hydroxypyrrolidine-2-carboxylic acid);silver
CID 50897483
2-aminoacetic acid;(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid
CID 67068644
(2S,4S)-4-hydroxypyrrolidine-2-carboxylic acid;2,2,2-trifluoroacetic acid
CID 129315200
2-[bis(2-hydroxyethyl)amino]ethanol;(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid
CID 174421816
(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;1H-pyrrole
CID 172843797
5-hydroxypiperidine-2-carboxylic acid;hydrochloride
CID 50896271
(2R,5S)-5-hydroxypiperidine-2-carboxylic acid;hydrochloride
CID 146013112
2-aminoacetic acid;(2S,4R)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-pyrrolidine-2-carboxylic acid
CID 66938353
4-hydroxypyrrolidine-2-carboxylic acid;2-(trimethylazaniumyl)acetate
CID 19098789
1-[(2S)-4-hydroxypyrrolidin-2-yl]ethanone
CID 154429079

Frequently Asked Questions

What is the IUPAC name of (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid?
The IUPAC name of (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid (CID 157188043) is (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid.
What is the SMILES notation for (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid?
The canonical SMILES for (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid is O=C(O)[C@@H]1CC(O)CN1.O=C(O)[C@@H]1CCC(O)N1.
What is the InChIKey of (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid?
The InChIKey is APIXUMPSQOVBBC-BUBOGGHKSA-N. The full InChI is InChI=1S/2C5H9NO3/c7-3-1-4(5(8)9)6-2-3;7-4-2-1-3(6-4)5(8)9/h2*3-4,6-7H,1-2H2,(H,8,9)/t3?,4-;3-,4?/m00/s1.
What are the key properties of (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid?
(2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid has a molecular weight of 262.26 g/mol, XLogP of -2.06, 2 rotatable bonds, 6 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-4-hydroxypyrrolidine-2-carboxylic acid;(2S)-5-hydroxypyrrolidine-2-carboxylic acid is sourced from PubChem (CID 157188043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).