4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid

C15H14N2O4 — CID 66221838

IUPAC4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid
SMILESO=C(NC1COCC1C(=O)O)c1cccc2cccnc12
InChIInChI=1S/C15H14N2O4/c18-14(17-12-8-21-7-11(12)15(19)20)10-5-1-3-9-4-2-6-16-13(9)10/h1-6,11-12H,7-8H2,(H,17,18)(H,19,20)
InChIKeyGSUKJVWNNUGEET-UHFFFAOYSA-N
MW286.29 g/mol
LogP1.06
Rot. Bonds3

About 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid

4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid (PubChem CID 66221838) has the molecular formula C15H14N2O4 and a molecular weight of 286.29 g/mol. Its IUPAC name is 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid.

Molecular Properties

Compound Name4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid
PubChem CID66221838
Molecular FormulaC15H14N2O4
Molecular Weight286.29 g/mol
Exact Mass286.10
IUPAC Name4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid
SMILESO=C(NC1COCC1C(=O)O)c1cccc2cccnc12
InChIInChI=1S/C15H14N2O4/c18-14(17-12-8-21-7-11(12)15(19)20)10-5-1-3-9-4-2-6-16-13(9)10/h1-6,11-12H,7-8H2,(H,17,18)(H,19,20)
InChIKeyGSUKJVWNNUGEET-UHFFFAOYSA-N
XLogP1.06
TPSA88.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.29
LogP ≤ 51.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-aminocyclopropyl)quinoline-8-carboxamide
CID 62875389
4-(pyridine-4-carbonylamino)oxolane-3-carboxylic acid
CID 66222895
4-[(2,6-dihydroxybenzoyl)amino]oxolane-3-carboxylic acid
CID 107688107
N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]quinoline-8-carboxamide
CID 69380368
4-(naphthalene-2-carbonylamino)oxolane-3-carboxylic acid
CID 66223547
4-[(3-hydroxybenzoyl)amino]oxolane-3-carboxylic acid
CID 66223322
4-[[2-(2-aminoethyl)benzoyl]amino]oxolane-3-carboxylic acid
CID 66238525
N'-[(1S,2R)-2-methylcyclopropanecarbonyl]quinoline-8-carbohydrazide
CID 97315545
4-[(3-fluorobenzoyl)amino]oxolane-3-carboxylic acid
CID 66223767
4-[(3-bromobenzoyl)amino]oxolane-3-carboxylic acid
CID 66223965
(2-phenylcyclopropyl)-quinolin-8-ylmethanone
CID 115790655
N-pyrimidin-2-ylquinoline-8-carboxamide
CID 175780986

Frequently Asked Questions

What is the IUPAC name of 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid?
The IUPAC name of 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid (CID 66221838) is 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid.
What is the SMILES notation for 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid?
The canonical SMILES for 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid is O=C(NC1COCC1C(=O)O)c1cccc2cccnc12.
What is the InChIKey of 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid?
The InChIKey is GSUKJVWNNUGEET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O4/c18-14(17-12-8-21-7-11(12)15(19)20)10-5-1-3-9-4-2-6-16-13(9)10/h1-6,11-12H,7-8H2,(H,17,18)(H,19,20).
What are the key properties of 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid?
4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid has a molecular weight of 286.29 g/mol, XLogP of 1.06, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(quinoline-8-carbonylamino)oxolane-3-carboxylic acid is sourced from PubChem (CID 66221838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).