2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid

C10H11NO3 — CID 99934799

IUPAC2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid
SMILESO=C(O)c1ccnc([C@@H]2CCOC2)c1
InChIInChI=1S/C10H11NO3/c12-10(13)7-1-3-11-9(5-7)8-2-4-14-6-8/h1,3,5,8H,2,4,6H2,(H,12,13)/t8-/m1/s1
InChIKeyGUFOXNGRJKMNLC-MRVPVSSYSA-N
MW193.20 g/mol
LogP1.28
Rot. Bonds2

About 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid

2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid (PubChem CID 99934799) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid
PubChem CID99934799
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid
SMILESO=C(O)c1ccnc([C@@H]2CCOC2)c1
InChIInChI=1S/C10H11NO3/c12-10(13)7-1-3-11-9(5-7)8-2-4-14-6-8/h1,3,5,8H,2,4,6H2,(H,12,13)/t8-/m1/s1
InChIKeyGUFOXNGRJKMNLC-MRVPVSSYSA-N
XLogP1.28
TPSA59.42 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-pyrrolidin-3-ylpyridine-4-carboxylic acid
CID 115018963
2-(oxolan-3-yloxy)pyridine-4-carboxylic acid
CID 63559237
3-[(3S)-oxolan-3-yl]benzoic acid
CID 97055073
3-[2-[[6-[(3R)-oxolan-3-yl]pyrimidin-4-yl]amino]ethoxy]benzoic acid
CID 125165387
2-(oxan-4-ylamino)pyridine-4-carboxylic acid
CID 43610330
2-(oxan-4-ylsulfanyl)pyridine-4-carboxylic acid
CID 55208597
4-[[6-(oxolan-3-yl)pyrimidin-4-yl]amino]butanoic acid
CID 118770776
6-[(3R)-oxolan-3-yl]quinoline-4-carboxylic acid
CID 170633420
6-(oxolan-3-yl)quinoline-4-carboxylic acid
CID 175960371
tert-butyl 4-[3-[2-(oxolan-3-yl)-4-pyridinyl]-1,2,4-oxadiazol-5-yl]piperidine-1-carboxylate
CID 137439530
3-[[6-(oxolan-3-yl)pyrimidin-4-yl]amino]cyclobutane-1-carboxylic acid
CID 118765525
3-[[6-[(3R)-oxolan-3-yl]pyrimidin-4-yl]amino]cyclobutane-1-carboxylic acid
CID 125162932

Frequently Asked Questions

What is the IUPAC name of 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid?
The IUPAC name of 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid (CID 99934799) is 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid.
What is the SMILES notation for 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid?
The canonical SMILES for 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid is O=C(O)c1ccnc([C@@H]2CCOC2)c1.
What is the InChIKey of 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid?
The InChIKey is GUFOXNGRJKMNLC-MRVPVSSYSA-N. The full InChI is InChI=1S/C10H11NO3/c12-10(13)7-1-3-11-9(5-7)8-2-4-14-6-8/h1,3,5,8H,2,4,6H2,(H,12,13)/t8-/m1/s1.
What are the key properties of 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid?
2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid has a molecular weight of 193.20 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3S)-oxolan-3-yl]pyridine-4-carboxylic acid is sourced from PubChem (CID 99934799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).