N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide

C17H20N2O3 — CID 540519

IUPACN-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide
SMILESCOc1cc(NC(=O)CCCC(C)=O)c2nccc(C)c2c1
InChIInChI=1S/C17H20N2O3/c1-11-7-8-18-17-14(11)9-13(22-3)10-15(17)19-16(21)6-4-5-12(2)20/h7-10H,4-6H2,1-3H3,(H,19,21)
InChIKeyAYCIPRQIBOJSTP-UHFFFAOYSA-N
MW300.36 g/mol
LogP3.25
Rot. Bonds6

About N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide

N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide (PubChem CID 540519) has the molecular formula C17H20N2O3 and a molecular weight of 300.36 g/mol. Its IUPAC name is N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide.

Molecular Properties

Compound NameN-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide
PubChem CID540519
Molecular FormulaC17H20N2O3
Molecular Weight300.36 g/mol
Exact Mass300.15
IUPAC NameN-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide
SMILESCOc1cc(NC(=O)CCCC(C)=O)c2nccc(C)c2c1
InChIInChI=1S/C17H20N2O3/c1-11-7-8-18-17-14(11)9-13(22-3)10-15(17)19-16(21)6-4-5-12(2)20/h7-10H,4-6H2,1-3H3,(H,19,21)
InChIKeyAYCIPRQIBOJSTP-UHFFFAOYSA-N
XLogP3.25
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.36
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-methyl-3-pyridinyl)-5-oxohexanamide
CID 75455735
1-[(6-methoxy-4-methylquinolin-8-yl)amino]hexan-1-ol
CID 86741428
2-[6-[(6-methoxy-4-methylquinolin-8-yl)amino]hexylamino]ethanol
CID 12618404
3-(3,5-dimethoxyphenyl)-N-(8-methylquinolin-5-yl)propanamide
CID 38267727
N,N'-bis(5-methoxy-2-methylphenyl)decanediamide
CID 10670784
[4-[6-[(6-methoxy-4-methylquinolin-8-yl)amino]hexyl]piperazin-1-yl] formate
CID 70431033
6-oxo-N-(1,10-phenanthrolin-5-yl)heptanamide
CID 20704834
N'-(6-methoxyquinolin-8-yl)-N-[3-[6-[3-[[4-[(6-methoxyquinolin-8-yl)amino]-4-oxobutanoyl]amino]propylamino]hexylamino]propyl]butanediamide
CID 164627794
N,N'-bis(4-methoxy-2-methylphenyl)decanediamide
CID 10836848
6-methoxy-8-methylquinoline-4-carboxylic acid
CID 83640648
2-ethyl-1-[4-[6-[(6-methoxy-4-methylquinolin-8-yl)amino]hexyl]piperazin-1-yl]butan-1-one;dihydrochloride
CID 13077553
N-(4-methoxyquinolin-8-yl)-4-methylsulfanylbutanamide
CID 75396693

Frequently Asked Questions

What is the IUPAC name of N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide?
The IUPAC name of N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide (CID 540519) is N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide.
What is the SMILES notation for N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide?
The canonical SMILES for N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide is COc1cc(NC(=O)CCCC(C)=O)c2nccc(C)c2c1.
What is the InChIKey of N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide?
The InChIKey is AYCIPRQIBOJSTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O3/c1-11-7-8-18-17-14(11)9-13(22-3)10-15(17)19-16(21)6-4-5-12(2)20/h7-10H,4-6H2,1-3H3,(H,19,21).
What are the key properties of N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide?
N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide has a molecular weight of 300.36 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methoxy-4-methylquinolin-8-yl)-5-oxohexanamide is sourced from PubChem (CID 540519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).