N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide

C23H24N2O4 — CID 3330477

IUPACN-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
SMILESCOc1ccc(N(Cc2cc3ccc(C)cc3[nH]c2=O)C(=O)C2CCCO2)cc1
InChIInChI=1S/C23H24N2O4/c1-15-5-6-16-13-17(22(26)24-20(16)12-15)14-25(23(27)21-4-3-11-29-21)18-7-9-19(28-2)10-8-18/h5-10,12-13,21H,3-4,11,14H2,1-2H3,(H,24,26)
InChIKeyZUMVNJFCEOOCQW-UHFFFAOYSA-N
MW392.46 g/mol
LogP3.56
Rot. Bonds5

About N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide

N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide (PubChem CID 3330477) has the molecular formula C23H24N2O4 and a molecular weight of 392.46 g/mol. Its IUPAC name is N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
PubChem CID3330477
Molecular FormulaC23H24N2O4
Molecular Weight392.46 g/mol
Exact Mass392.17
IUPAC NameN-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
SMILESCOc1ccc(N(Cc2cc3ccc(C)cc3[nH]c2=O)C(=O)C2CCCO2)cc1
InChIInChI=1S/C23H24N2O4/c1-15-5-6-16-13-17(22(26)24-20(16)12-15)14-25(23(27)21-4-3-11-29-21)18-7-9-19(28-2)10-8-18/h5-10,12-13,21H,3-4,11,14H2,1-2H3,(H,24,26)
InChIKeyZUMVNJFCEOOCQW-UHFFFAOYSA-N
XLogP3.56
TPSA71.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.46
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
The IUPAC name of N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide (CID 3330477) is N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide.
What is the SMILES notation for N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
The canonical SMILES for N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide is COc1ccc(N(Cc2cc3ccc(C)cc3[nH]c2=O)C(=O)C2CCCO2)cc1.
What is the InChIKey of N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
The InChIKey is ZUMVNJFCEOOCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N2O4/c1-15-5-6-16-13-17(22(26)24-20(16)12-15)14-25(23(27)21-4-3-11-29-21)18-7-9-19(28-2)10-8-18/h5-10,12-13,21H,3-4,11,14H2,1-2H3,(H,24,26).
What are the key properties of N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide?
N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide has a molecular weight of 392.46 g/mol, XLogP of 3.56, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide is sourced from PubChem (CID 3330477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).