(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide

C18H22N2O4 — CID 2036915

IUPAC(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
SMILESCOCCN(Cc1cc2ccccc2[nH]c1=O)C(=O)[C@H]1CCCO1
InChIInChI=1S/C18H22N2O4/c1-23-10-8-20(18(22)16-7-4-9-24-16)12-14-11-13-5-2-3-6-15(13)19-17(14)21/h2-3,5-6,11,16H,4,7-10,12H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyIRGUNPIWHWPAFY-MRXNPFEDSA-N
MW330.38 g/mol
LogP1.68
Rot. Bonds6

About (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide

(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide (PubChem CID 2036915) has the molecular formula C18H22N2O4 and a molecular weight of 330.38 g/mol. Its IUPAC name is (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide.

Molecular Properties

Compound Name(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
PubChem CID2036915
Molecular FormulaC18H22N2O4
Molecular Weight330.38 g/mol
Exact Mass330.16
IUPAC Name(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
SMILESCOCCN(Cc1cc2ccccc2[nH]c1=O)C(=O)[C@H]1CCCO1
InChIInChI=1S/C18H22N2O4/c1-23-10-8-20(18(22)16-7-4-9-24-16)12-14-11-13-5-2-3-6-15(13)19-17(14)21/h2-3,5-6,11,16H,4,7-10,12H2,1H3,(H,19,21)/t16-/m1/s1
InChIKeyIRGUNPIWHWPAFY-MRXNPFEDSA-N
XLogP1.68
TPSA71.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.38
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
The IUPAC name of (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide (CID 2036915) is (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide.
What is the SMILES notation for (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
The canonical SMILES for (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide is COCCN(Cc1cc2ccccc2[nH]c1=O)C(=O)[C@H]1CCCO1.
What is the InChIKey of (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
The InChIKey is IRGUNPIWHWPAFY-MRXNPFEDSA-N. The full InChI is InChI=1S/C18H22N2O4/c1-23-10-8-20(18(22)16-7-4-9-24-16)12-14-11-13-5-2-3-6-15(13)19-17(14)21/h2-3,5-6,11,16H,4,7-10,12H2,1H3,(H,19,21)/t16-/m1/s1.
What are the key properties of (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
(2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide has a molecular weight of 330.38 g/mol, XLogP of 1.68, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2-methoxyethyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide is sourced from PubChem (CID 2036915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).