5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid

C14H10N2O3 — CID 22135397

IUPAC5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid
SMILESO=C1Cc2c(cccc2-c2cncc(C(=O)O)c2)N1
InChIInChI=1S/C14H10N2O3/c17-13-5-11-10(2-1-3-12(11)16-13)8-4-9(14(18)19)7-15-6-8/h1-4,6-7H,5H2,(H,16,17)(H,18,19)
InChIKeyONLZJAXHNQWSTQ-UHFFFAOYSA-N
MW254.25 g/mol
LogP1.94
Rot. Bonds2

About 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid

5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid (PubChem CID 22135397) has the molecular formula C14H10N2O3 and a molecular weight of 254.25 g/mol. Its IUPAC name is 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid
PubChem CID22135397
Molecular FormulaC14H10N2O3
Molecular Weight254.25 g/mol
Exact Mass254.07
IUPAC Name5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid
SMILESO=C1Cc2c(cccc2-c2cncc(C(=O)O)c2)N1
InChIInChI=1S/C14H10N2O3/c17-13-5-11-10(2-1-3-12(11)16-13)8-4-9(14(18)19)7-15-6-8/h1-4,6-7H,5H2,(H,16,17)(H,18,19)
InChIKeyONLZJAXHNQWSTQ-UHFFFAOYSA-N
XLogP1.94
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

Indole-3-Carboxylic Acid
CID 69867
2-Methyl-3-[(pyridin-3-ylmethyl)-amino]-benzoic acid
CID 6492091
5-Phenylpyridine-3-carboxylic acid
CID 346160
(3Z)-2-oxo-3-({4-oxo-2H,4H,5H,6H,7H-pyrrolo[3,4-c]pyridin-1-yl}methylidene)-2,3-dihydro-1H-indole-5-carboxylic acid
CID 5331098
2-{3-[4-(Pyridin-2-yl)phenyl]propanamido}benzoic acid
CID 11566404
Pyrrolopyridine, 31
CID 16720315
2-[(Cyclopropylcarbonyl)amino]-5-[methyl(pyridin-3-ylmethyl)amino]benzoic acid
CID 44631844
3-[2-(Dimethylamino)ethylcarbamoyl]pyrido[1,2-a]indole-10-carboxylic acid
CID 56589667
2-[(Pyridin-3-ylmethyl)amino]benzoic acid
CID 3442459
2-Methyl-3-[(pyridin-4-ylmethyl)-amino]-benzoic acid
CID 6492090
Tmc-205
CID 9794548
Indole-4-carboxylic acid
CID 595229

Frequently Asked Questions

What is the IUPAC name of 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid?
The IUPAC name of 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid (CID 22135397) is 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid.
What is the SMILES notation for 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid?
The canonical SMILES for 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid is O=C1Cc2c(cccc2-c2cncc(C(=O)O)c2)N1.
What is the InChIKey of 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid?
The InChIKey is ONLZJAXHNQWSTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3/c17-13-5-11-10(2-1-3-12(11)16-13)8-4-9(14(18)19)7-15-6-8/h1-4,6-7H,5H2,(H,16,17)(H,18,19).
What are the key properties of 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid?
5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid has a molecular weight of 254.25 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-oxo-1,3-dihydroindol-4-yl)pyridine-3-carboxylic acid is sourced from PubChem (CID 22135397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).