8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid

C15H14N2O5 — CID 70304711

IUPAC8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid
SMILESO=C(O)c1cc(N2CCOCC2)c2cc3c(cc2n1)OCO3
InChIInChI=1S/C15H14N2O5/c18-15(19)11-6-12(17-1-3-20-4-2-17)9-5-13-14(22-8-21-13)7-10(9)16-11/h5-7H,1-4,8H2,(H,18,19)
InChIKeyQFEUEDXAKKKMPH-UHFFFAOYSA-N
MW302.29 g/mol
LogP1.50
Rot. Bonds2

About 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid

8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid (PubChem CID 70304711) has the molecular formula C15H14N2O5 and a molecular weight of 302.29 g/mol. Its IUPAC name is 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid.

Molecular Properties

Compound Name8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid
PubChem CID70304711
Molecular FormulaC15H14N2O5
Molecular Weight302.29 g/mol
Exact Mass302.09
IUPAC Name8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid
SMILESO=C(O)c1cc(N2CCOCC2)c2cc3c(cc2n1)OCO3
InChIInChI=1S/C15H14N2O5/c18-15(19)11-6-12(17-1-3-20-4-2-17)9-5-13-14(22-8-21-13)7-10(9)16-11/h5-7H,1-4,8H2,(H,18,19)
InChIKeyQFEUEDXAKKKMPH-UHFFFAOYSA-N
XLogP1.50
TPSA81.12 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.29
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

4-piperidin-1-ylquinoline-2-carboxylic acid
CID 55222187
4-methoxy-6-morpholin-4-ylquinoline-2-carboxylic acid
CID 102942059
5-(1,3-benzodioxol-5-ylmethylamino)-2-morpholin-4-ylbenzoic acid
CID 667343
N-(1,3-benzodioxol-5-yl)-2-morpholin-4-ylpyrimidine-4-carboxamide
CID 109300487
N'-(1,3-benzodioxole-5-carbonyl)-2-morpholin-4-yl-1,3-thiazole-4-carbohydrazide
CID 18120599
4-(morpholin-4-ylamino)quinoline-2-carboxylic acid
CID 83026481
[1,3]dioxolo[4,5-g]cinnoline-4-carboxylic acid
CID 23401185
4-(1,4-thiazepan-4-yl)quinoline-2-carboxylic acid
CID 63374218
1-methyl-4-[1-(6-methyl-[1,3]dioxolo[4,5-g]quinolin-8-yl)piperidin-4-yl]pyridin-2-one
CID 138382688
4-morpholin-4-ylpyridine-2,5-dicarboxamide
CID 155353746
4-[2-(1,3-benzodioxol-5-yl)-1,3-thiazole-4-carbonyl]morpholine-3-carboxylic acid
CID 119216582
4-morpholin-4-yl-2-[3-oxo-3-[4-(pyrrolidine-1-carbonyl)phenyl]prop-1-enyl]quinoline-6-carboxylic acid
CID 141127616

Frequently Asked Questions

What is the IUPAC name of 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid?
The IUPAC name of 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid (CID 70304711) is 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid.
What is the SMILES notation for 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid?
The canonical SMILES for 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid is O=C(O)c1cc(N2CCOCC2)c2cc3c(cc2n1)OCO3.
What is the InChIKey of 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid?
The InChIKey is QFEUEDXAKKKMPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O5/c18-15(19)11-6-12(17-1-3-20-4-2-17)9-5-13-14(22-8-21-13)7-10(9)16-11/h5-7H,1-4,8H2,(H,18,19).
What are the key properties of 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid?
8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid has a molecular weight of 302.29 g/mol, XLogP of 1.50, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 8-morpholin-4-yl-[1,3]dioxolo[4,5-g]quinoline-6-carboxylic acid is sourced from PubChem (CID 70304711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).