(2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid

C10H16N2O5 — CID 174738513

IUPAC(2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid
SMILESO=C(O)[C@H]1C[C@H](O)CN1N1CCC[C@H]1C(=O)O
InChIInChI=1S/C10H16N2O5/c13-6-4-8(10(16)17)12(5-6)11-3-1-2-7(11)9(14)15/h6-8,13H,1-5H2,(H,14,15)(H,16,17)/t6-,7-,8+/m0/s1
InChIKeyCLQRNIXVZBRBQY-BIIVOSGPSA-N
MW244.25 g/mol
LogP-1.03
Rot. Bonds3

About (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid

(2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid (PubChem CID 174738513) has the molecular formula C10H16N2O5 and a molecular weight of 244.25 g/mol. Its IUPAC name is (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name(2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid
PubChem CID174738513
Molecular FormulaC10H16N2O5
Molecular Weight244.25 g/mol
Exact Mass244.11
IUPAC Name(2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid
SMILESO=C(O)[C@H]1C[C@H](O)CN1N1CCC[C@H]1C(=O)O
InChIInChI=1S/C10H16N2O5/c13-6-4-8(10(16)17)12(5-6)11-3-1-2-7(11)9(14)15/h6-8,13H,1-5H2,(H,14,15)(H,16,17)/t6-,7-,8+/m0/s1
InChIKeyCLQRNIXVZBRBQY-BIIVOSGPSA-N
XLogP-1.03
TPSA101.31 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.25
LogP ≤ 5-1.03
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

1-[1-(2-aminoacetyl)-4-hydroxypyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 139211128
4-hydroxy-1-(2-methylpyrrolidine-1-carbonyl)pyrrolidine-2-carboxylic acid
CID 61207457
(2S)-1-morpholin-4-ylpyrrolidine-2-carboxylic acid
CID 70469411
(2S,4R)-1-cyclohexyl-4-hydroxypyrrolidine-2-carboxylic acid
CID 67775431
(2S,4R)-4-hydroxy-1-(3-methylpiperidine-1-carbonyl)pyrrolidine-2-carboxylic acid
CID 55260359
(4R)-4-hydroxy-1-methylpyrrolidine-2-carboxylic acid
CID 58820492
(2R,4R)-4-hydroxy-1-methylpyrrolidine-2-carboxylic acid
CID 58493970
(2S,4S)-1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 30046185
1-(cyclobutanecarbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 16775594
(2R,4R)-1-(2-cyclopentylpyrrolidine-1-carbonyl)-4-hydroxypyrrolidine-2-carboxylic acid
CID 79000492
(2S)-1-chloropyrrolidine-2-carboxylic acid
CID 25009763
(2S,4S)-4-hydroxy-1-(4-hydroxypiperidine-1-carbonyl)pyrrolidine-2-carboxylic acid
CID 64714272

Frequently Asked Questions

What is the IUPAC name of (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid?
The IUPAC name of (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid (CID 174738513) is (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid.
What is the SMILES notation for (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid?
The canonical SMILES for (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid is O=C(O)[C@H]1C[C@H](O)CN1N1CCC[C@H]1C(=O)O.
What is the InChIKey of (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid?
The InChIKey is CLQRNIXVZBRBQY-BIIVOSGPSA-N. The full InChI is InChI=1S/C10H16N2O5/c13-6-4-8(10(16)17)12(5-6)11-3-1-2-7(11)9(14)15/h6-8,13H,1-5H2,(H,14,15)(H,16,17)/t6-,7-,8+/m0/s1.
What are the key properties of (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid?
(2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid has a molecular weight of 244.25 g/mol, XLogP of -1.03, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,4S)-1-[(2S)-2-carboxypyrrolidin-1-yl]-4-hydroxypyrrolidine-2-carboxylic acid is sourced from PubChem (CID 174738513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).