6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one

C10H12N2O4 — CID 66260859

IUPAC6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1cc(O)[nH]c(=O)c1)N1CC[C@@H](O)C1
InChIInChI=1S/C10H12N2O4/c13-7-1-2-12(5-7)10(16)6-3-8(14)11-9(15)4-6/h3-4,7,13H,1-2,5H2,(H2,11,14,15)/t7-/m1/s1
InChIKeyWPWNJHVESWFUBL-SSDOTTSWSA-N
MW224.22 g/mol
LogP-0.71
Rot. Bonds1

About 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one

6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one (PubChem CID 66260859) has the molecular formula C10H12N2O4 and a molecular weight of 224.22 g/mol. Its IUPAC name is 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one
PubChem CID66260859
Molecular FormulaC10H12N2O4
Molecular Weight224.22 g/mol
Exact Mass224.08
IUPAC Name6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one
SMILESO=C(c1cc(O)[nH]c(=O)c1)N1CC[C@@H](O)C1
InChIInChI=1S/C10H12N2O4/c13-7-1-2-12(5-7)10(16)6-3-8(14)11-9(15)4-6/h3-4,7,13H,1-2,5H2,(H2,11,14,15)/t7-/m1/s1
InChIKeyWPWNJHVESWFUBL-SSDOTTSWSA-N
XLogP-0.71
TPSA93.63 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.22
LogP ≤ 5-0.71
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

6-hydroxy-4-[3-(2-hydroxyethyl)pyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 114799248
4-(4-amino-3-ethylpiperidine-1-carbonyl)-6-hydroxy-1H-pyridin-2-one
CID 81457773
6-hydroxy-4-(piperazine-1-carbonyl)-1H-pyridin-2-one
CID 24699091
4-[3-(4-cyclohexylpiperazin-1-yl)azetidine-1-carbonyl]-6-hydroxy-1H-pyridin-2-one
CID 126892532
4-[3-(4-fluorophenyl)azepane-1-carbonyl]-6-hydroxy-1H-pyridin-2-one
CID 121146340
ethyl (3R)-1-(2-hydroxy-6-oxo-1H-pyridine-4-carbonyl)piperidine-3-carboxylate
CID 115538799
1-(2-hydroxy-6-oxo-1H-pyridine-4-carbonyl)-3-methylpyrrolidine-2-carboxylic acid
CID 102776148
[(3S)-3-hydroxypyrrolidin-1-yl]-(5-methylthiophen-3-yl)methanone
CID 130949994
2H-benzotriazol-5-yl-[(3S)-3-hydroxypyrrolidin-1-yl]methanone
CID 79029470
(3-chloro-4-hydroxyphenyl)-(3-hydroxypyrrolidin-1-yl)methanone
CID 62918769
6-[(3S)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one
CID 107262059
(4-hydroxy-3-methylphenyl)-[(3S)-3-hydroxypyrrolidin-1-yl]methanone
CID 59238538

Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one?
The IUPAC name of 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one (CID 66260859) is 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one?
The canonical SMILES for 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one is O=C(c1cc(O)[nH]c(=O)c1)N1CC[C@@H](O)C1.
What is the InChIKey of 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one?
The InChIKey is WPWNJHVESWFUBL-SSDOTTSWSA-N. The full InChI is InChI=1S/C10H12N2O4/c13-7-1-2-12(5-7)10(16)6-3-8(14)11-9(15)4-6/h3-4,7,13H,1-2,5H2,(H2,11,14,15)/t7-/m1/s1.
What are the key properties of 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one?
6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one has a molecular weight of 224.22 g/mol, XLogP of -0.71, 1 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-4-[(3R)-3-hydroxypyrrolidine-1-carbonyl]-1H-pyridin-2-one is sourced from PubChem (CID 66260859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).