1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide

C15H18N2O3 — CID 172806443

IUPAC1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide
SMILESNC(=O)C1=Cc2ccccc2N(OCC2CCOC2)C1
InChIInChI=1S/C15H18N2O3/c16-15(18)13-7-12-3-1-2-4-14(12)17(8-13)20-10-11-5-6-19-9-11/h1-4,7,11H,5-6,8-10H2,(H2,16,18)
InChIKeyRORJMLWXYMVMEY-UHFFFAOYSA-N
MW274.32 g/mol
LogP1.34
Rot. Bonds4

About 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide

1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide (PubChem CID 172806443) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide.

Molecular Properties

Compound Name1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide
PubChem CID172806443
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide
SMILESNC(=O)C1=Cc2ccccc2N(OCC2CCOC2)C1
InChIInChI=1S/C15H18N2O3/c16-15(18)13-7-12-3-1-2-4-14(12)17(8-13)20-10-11-5-6-19-9-11/h1-4,7,11H,5-6,8-10H2,(H2,16,18)
InChIKeyRORJMLWXYMVMEY-UHFFFAOYSA-N
XLogP1.34
TPSA64.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(Pyrrolidinylmethyl)quinolin-2-one
CID 129875049
N-ethoxy-2-oxo-1H-quinoline-3-carboxamide
CID 45868832
N,2-dimethyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 946015
4-Hydroxy quinolone-3-carboxamide
CID 21687000
4-fluoro-12-(2H-quinolin-1-yloxy)dodeca-2,4-dienamide
CID 141570811
N-Methoxy-2-oxo-1,2-dihydroquinoline-3-carboxamide
CID 13163172
3-[(2,2,2-trifluoroethoxyamino)methyl]-1H-quinolin-2-one
CID 82711600
1-pentyl-2H-quinoline-3-carboxamide
CID 66821468
1,2-oxazol-3-one;1H-quinolin-2-one
CID 69784177
1-Oxido-1,2-dihydroquinolin-1-ium-3-carboxamide
CID 87243833
1-Oxido-1,2-dihydroquinolin-1-ium-3-carboxamide;hydrochloride
CID 87243954
N-oxo-1,2-dihydroquinoline-3-carboxamide
CID 88532555

Frequently Asked Questions

What is the IUPAC name of 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide?
The IUPAC name of 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide (CID 172806443) is 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide.
What is the SMILES notation for 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide?
The canonical SMILES for 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide is NC(=O)C1=Cc2ccccc2N(OCC2CCOC2)C1.
What is the InChIKey of 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide?
The InChIKey is RORJMLWXYMVMEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c16-15(18)13-7-12-3-1-2-4-14(12)17(8-13)20-10-11-5-6-19-9-11/h1-4,7,11H,5-6,8-10H2,(H2,16,18).
What are the key properties of 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide?
1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 1.34, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(oxolan-3-ylmethoxy)-2H-quinoline-3-carboxamide is sourced from PubChem (CID 172806443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).