5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid

C9H10N2O3 — CID 138689746

IUPAC5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1ccc(C2(O)CNC2)cn1
InChIInChI=1S/C9H10N2O3/c12-8(13)7-2-1-6(3-11-7)9(14)4-10-5-9/h1-3,10,14H,4-5H2,(H,12,13)
InChIKeyGGHGADPFANIBDX-UHFFFAOYSA-N
MW194.19 g/mol
LogP-0.43
Rot. Bonds2

About 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid

5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid (PubChem CID 138689746) has the molecular formula C9H10N2O3 and a molecular weight of 194.19 g/mol. Its IUPAC name is 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid
PubChem CID138689746
Molecular FormulaC9H10N2O3
Molecular Weight194.19 g/mol
Exact Mass194.07
IUPAC Name5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid
SMILESO=C(O)c1ccc(C2(O)CNC2)cn1
InChIInChI=1S/C9H10N2O3/c12-8(13)7-2-1-6(3-11-7)9(14)4-10-5-9/h1-3,10,14H,4-5H2,(H,12,13)
InChIKeyGGHGADPFANIBDX-UHFFFAOYSA-N
XLogP-0.43
TPSA82.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.19
LogP ≤ 5-0.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

5-[2-(4-fluorophenyl)oxolan-2-yl]pyridine-2-carboxylic acid
CID 146260178
pyridine-2,5-dicarboxylic acid
CID 158970171
5-(4-tert-butyl-2,5-dioxoimidazolidin-4-yl)pyridine-2-carboxylic acid
CID 134495197
(3S)-3-(6-methyl-3-pyridinyl)pyrrolidin-3-ol
CID 124508626
3-pyridin-4-ylazetidin-3-ol
CID 83681885
5-hydroxypyridine-2-carboxylic acid;hydrate
CID 44607741
5-(3-cyanooxolan-3-yl)pyridine-2-carboxylic acid
CID 130407792
5-[bis(4-chlorophenyl)methyl]pyridine-2-carboxylic acid;piperazine
CID 70605419
(2,2,2-trifluoroacetyl) 5-(3-fluoroazetidin-3-yl)pyridine-2-carboxylate
CID 138689750
3-(4-bromophenyl)azetidin-3-ol;hydrochloride
CID 122164542
5-[(S)-amino(carboxy)methyl]pyridine-2-carboxylic acid
CID 130679702
sodium;hydride;5-methylpyridine-2-carboxylic acid
CID 173118814

Frequently Asked Questions

What is the IUPAC name of 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid?
The IUPAC name of 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid (CID 138689746) is 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid.
What is the SMILES notation for 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid?
The canonical SMILES for 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid is O=C(O)c1ccc(C2(O)CNC2)cn1.
What is the InChIKey of 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid?
The InChIKey is GGHGADPFANIBDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O3/c12-8(13)7-2-1-6(3-11-7)9(14)4-10-5-9/h1-3,10,14H,4-5H2,(H,12,13).
What are the key properties of 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid?
5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid has a molecular weight of 194.19 g/mol, XLogP of -0.43, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-hydroxyazetidin-3-yl)pyridine-2-carboxylic acid is sourced from PubChem (CID 138689746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).