N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide

C22H24N2O5 — CID 110426059

IUPACN-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
SMILESCOc1ccc2[nH]c(=O)c(CCC(=O)N(C)c3ccc(OC)c(OC)c3)cc2c1
InChIInChI=1S/C22H24N2O5/c1-24(16-6-9-19(28-3)20(13-16)29-4)21(25)10-5-14-11-15-12-17(27-2)7-8-18(15)23-22(14)26/h6-9,11-13H,5,10H2,1-4H3,(H,23,26)
InChIKeyKRODWQYLTMQTNQ-UHFFFAOYSA-N
MW396.44 g/mol
LogP3.15
Rot. Bonds7

About N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide

N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide (PubChem CID 110426059) has the molecular formula C22H24N2O5 and a molecular weight of 396.44 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
PubChem CID110426059
Molecular FormulaC22H24N2O5
Molecular Weight396.44 g/mol
Exact Mass396.17
IUPAC NameN-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
SMILESCOc1ccc2[nH]c(=O)c(CCC(=O)N(C)c3ccc(OC)c(OC)c3)cc2c1
InChIInChI=1S/C22H24N2O5/c1-24(16-6-9-19(28-3)20(13-16)29-4)21(25)10-5-14-11-15-12-17(27-2)7-8-18(15)23-22(14)26/h6-9,11-13H,5,10H2,1-4H3,(H,23,26)
InChIKeyKRODWQYLTMQTNQ-UHFFFAOYSA-N
XLogP3.15
TPSA80.86 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.44
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N,N-diethyl-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 53174783
N-[(3,4-dimethoxyphenyl)methyl]-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 53174760
N-methyl-3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-phenylpropanamide
CID 110331251
3-(hydroxymethyl)-6-methoxy-1H-quinolin-2-one
CID 865120
N-(3,5-dimethylphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331323
2-methoxy-N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-methylbenzamide
CID 1427730
3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-(2-propan-2-yloxyethyl)propanamide
CID 110418808
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N,3-dimethylbutanamide
CID 907840
N-butyl-3-(7-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide
CID 110298878
N-[(2-fluorophenyl)methyl]-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331295
N-(2,6-difluorophenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)propanamide
CID 110428860
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methoxyphenyl)butanamide
CID 3157383

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide (CID 110426059) is N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide is COc1ccc2[nH]c(=O)c(CCC(=O)N(C)c3ccc(OC)c(OC)c3)cc2c1.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
The InChIKey is KRODWQYLTMQTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O5/c1-24(16-6-9-19(28-3)20(13-16)29-4)21(25)10-5-14-11-15-12-17(27-2)7-8-18(15)23-22(14)26/h6-9,11-13H,5,10H2,1-4H3,(H,23,26).
What are the key properties of N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide?
N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide has a molecular weight of 396.44 g/mol, XLogP of 3.15, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-3-(6-methoxy-2-oxo-1H-quinolin-3-yl)-N-methylpropanamide is sourced from PubChem (CID 110426059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).