N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide

C23H26N2O4 — CID 1427665

IUPACN-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide
SMILESCCOc1ccc(N(Cc2cc3ccc(OC)cc3[nH]c2=O)C(=O)C(C)C)cc1
InChIInChI=1S/C23H26N2O4/c1-5-29-19-10-7-18(8-11-19)25(23(27)15(2)3)14-17-12-16-6-9-20(28-4)13-21(16)24-22(17)26/h6-13,15H,5,14H2,1-4H3,(H,24,26)
InChIKeyRTDRXJRXRLVGOJ-UHFFFAOYSA-N
MW394.47 g/mol
LogP4.12
Rot. Bonds7

About N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide

N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide (PubChem CID 1427665) has the molecular formula C23H26N2O4 and a molecular weight of 394.47 g/mol. Its IUPAC name is N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide.

Molecular Properties

Compound NameN-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide
PubChem CID1427665
Molecular FormulaC23H26N2O4
Molecular Weight394.47 g/mol
Exact Mass394.19
IUPAC NameN-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide
SMILESCCOc1ccc(N(Cc2cc3ccc(OC)cc3[nH]c2=O)C(=O)C(C)C)cc1
InChIInChI=1S/C23H26N2O4/c1-5-29-19-10-7-18(8-11-19)25(23(27)15(2)3)14-17-12-16-6-9-20(28-4)13-21(16)24-22(17)26/h6-13,15H,5,14H2,1-4H3,(H,24,26)
InChIKeyRTDRXJRXRLVGOJ-UHFFFAOYSA-N
XLogP4.12
TPSA71.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.47
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methoxyphenyl)-2-methyl-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 1420271
N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]furan-2-carboxamide
CID 3283896
N-(4-ethoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 1417601
N-(4-ethoxyphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 1389745
N-(4-ethoxyphenyl)-2-methoxy-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1391190
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-(4-methoxyphenyl)-N-propan-2-ylacetamide
CID 3430411
N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-methoxyphenyl)acetamide
CID 5036839
2-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110324772
N-ethyl-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-phenoxyacetamide
CID 1396367
4-tert-butyl-N-(4-ethoxyphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 2066349
2-ethoxy-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylbenzamide
CID 3442794
(2R)-N-(4-ethoxyphenyl)-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]oxolane-2-carboxamide
CID 1395949

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide?
The IUPAC name of N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide (CID 1427665) is N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide.
What is the SMILES notation for N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide?
The canonical SMILES for N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide is CCOc1ccc(N(Cc2cc3ccc(OC)cc3[nH]c2=O)C(=O)C(C)C)cc1.
What is the InChIKey of N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide?
The InChIKey is RTDRXJRXRLVGOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O4/c1-5-29-19-10-7-18(8-11-19)25(23(27)15(2)3)14-17-12-16-6-9-20(28-4)13-21(16)24-22(17)26/h6-13,15H,5,14H2,1-4H3,(H,24,26).
What are the key properties of N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide?
N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide has a molecular weight of 394.47 g/mol, XLogP of 4.12, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxyphenyl)-N-[(7-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-2-methylpropanamide is sourced from PubChem (CID 1427665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).