7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid

C13H11NO4 — CID 136968132

IUPAC7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid
SMILESO=C(O)c1c2c(nc3cc(O)ccc13)CCOC2
InChIInChI=1S/C13H11NO4/c15-7-1-2-8-11(5-7)14-10-3-4-18-6-9(10)12(8)13(16)17/h1-2,5,15H,3-4,6H2,(H,16,17)
InChIKeyDOWCSGMBZHLSLP-UHFFFAOYSA-N
MW245.23 g/mol
LogP1.71
Rot. Bonds1

About 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid

7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid (PubChem CID 136968132) has the molecular formula C13H11NO4 and a molecular weight of 245.23 g/mol. Its IUPAC name is 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid.

Molecular Properties

Compound Name7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid
PubChem CID136968132
Molecular FormulaC13H11NO4
Molecular Weight245.23 g/mol
Exact Mass245.07
IUPAC Name7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid
SMILESO=C(O)c1c2c(nc3cc(O)ccc13)CCOC2
InChIInChI=1S/C13H11NO4/c15-7-1-2-8-11(5-7)14-10-3-4-18-6-9(10)12(8)13(16)17/h1-2,5,15H,3-4,6H2,(H,16,17)
InChIKeyDOWCSGMBZHLSLP-UHFFFAOYSA-N
XLogP1.71
TPSA79.65 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.23
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6,8-dibromo-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid
CID 60985694
N-(3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-yl)cyclopropanecarboxamide
CID 167911317
1,2,3,4-tetrahydroacridine-9-carboxylic acid;hydrate
CID 16667447
6-chloro-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
CID 63462975
6-fluoro-2-methyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid
CID 43180336
methyl 3-hydroxyacridine-9-carboxylate
CID 135618678
8-bromo-10-chloro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471013
10-chloro-8-fluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471001
morpholin-4-yl(1,2,3,4-tetrahydrobenzo[b][1,6]naphthyridin-10-yl)methanone
CID 58440618
3-methyl-2-[(E)-2-(2-methyl-6,7-dihydro-4H-pyrano[4,3-c]pyrazol-3-yl)ethenyl]quinoline-4-carboxylic acid
CID 167803005
8,10-dichloro-7-fluoro-3,4-dihydro-1H-pyrano[4,3-b]quinoline
CID 106471040
(8-tert-butyl-3,4-dihydro-1H-pyrano[4,3-b]quinolin-10-yl)hydrazine
CID 106473750

Frequently Asked Questions

What is the IUPAC name of 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid?
The IUPAC name of 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid (CID 136968132) is 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid.
What is the SMILES notation for 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid?
The canonical SMILES for 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid is O=C(O)c1c2c(nc3cc(O)ccc13)CCOC2.
What is the InChIKey of 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid?
The InChIKey is DOWCSGMBZHLSLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO4/c15-7-1-2-8-11(5-7)14-10-3-4-18-6-9(10)12(8)13(16)17/h1-2,5,15H,3-4,6H2,(H,16,17).
What are the key properties of 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid?
7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid has a molecular weight of 245.23 g/mol, XLogP of 1.71, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-hydroxy-3,4-dihydro-1H-pyrano[4,3-b]quinoline-10-carboxylic acid is sourced from PubChem (CID 136968132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).