1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid

C10H16N2O4 — CID 61156945

IUPAC1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)C1CCCN1C(=O)C1CC(O)CN1
InChIInChI=1S/C10H16N2O4/c13-6-4-7(11-5-6)9(14)12-3-1-2-8(12)10(15)16/h6-8,11,13H,1-5H2,(H,15,16)
InChIKeyGIOMWAZJQDYWEU-UHFFFAOYSA-N
MW228.25 g/mol
LogP-1.22
Rot. Bonds2

About 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid

1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid (PubChem CID 61156945) has the molecular formula C10H16N2O4 and a molecular weight of 228.25 g/mol. Its IUPAC name is 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid.

Molecular Properties

Compound Name1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid
PubChem CID61156945
Molecular FormulaC10H16N2O4
Molecular Weight228.25 g/mol
Exact Mass228.11
IUPAC Name1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid
SMILESO=C(O)C1CCCN1C(=O)C1CC(O)CN1
InChIInChI=1S/C10H16N2O4/c13-6-4-7(11-5-6)9(14)12-3-1-2-8(12)10(15)16/h6-8,11,13H,1-5H2,(H,15,16)
InChIKeyGIOMWAZJQDYWEU-UHFFFAOYSA-N
XLogP-1.22
TPSA89.87 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[(2S)-1-[(2S,4R)-4-hydroxypyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]acetic acid
CID 101267436
(2R)-1-(4-methylpiperidine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 103869598
1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 61158797
(2R)-1-(piperidine-2-carbonyl)pyrrolidine-2-carboxylic acid
CID 78923169
1-(4-hydroxypyrrolidine-2-carbonyl)-3-methylpyrrolidine-2-carboxylic acid
CID 102780201
(4R)-3-(4-hydroxypyrrolidine-2-carbonyl)-1,3-thiazolidine-4-carboxylic acid
CID 61161522
(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 102311837
1-(1,3-thiazolidine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 61158601
(2R)-1-(1,3-thiazolidine-4-carbonyl)pyrrolidine-2-carboxylic acid
CID 78923109
acetic acid;(2S)-1-[(2S)-pyrrolidine-2-carbonyl]pyrrolidine-2-carboxylic acid
CID 175939790
(2-benzhydrylpyrrolidin-1-yl)-(4-hydroxypyrrolidin-2-yl)methanone
CID 73158126
1-(pyrrolidine-2-carbonyl)piperidine-2-carboxylic acid
CID 61157904

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid?
The IUPAC name of 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid (CID 61156945) is 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid.
What is the SMILES notation for 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid?
The canonical SMILES for 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid is O=C(O)C1CCCN1C(=O)C1CC(O)CN1.
What is the InChIKey of 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid?
The InChIKey is GIOMWAZJQDYWEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O4/c13-6-4-7(11-5-6)9(14)12-3-1-2-8(12)10(15)16/h6-8,11,13H,1-5H2,(H,15,16).
What are the key properties of 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid?
1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid has a molecular weight of 228.25 g/mol, XLogP of -1.22, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxypyrrolidine-2-carbonyl)pyrrolidine-2-carboxylic acid is sourced from PubChem (CID 61156945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).