N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one

C136H140N20O20 — CID 160969076

IUPACN,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one
SMILESCNC(=O)Cn1cc(C)c(=O)c2ccccc21.COCCn1cc(C)c(=O)c2ccccc21.COc1c(C)cnc2ccccc12.Cc1c[nH]c2ccccc2c1=O.Cc1c[nH]c2cnccc2c1=O.Cc1c[nH]c2ncccc2c1=O.Cc1c[nH]c2ncncc2c1=O.Cc1c[nH]ccc1=O.Cc1cn(C)ccc1=O.Cc1cn(CC(=O)N(C)C)c2ccccc2c1=O.Cc1cn(CC(=O)O)c2ccccc2c1=O.Cc1cn(CC(N)=O)c2ccccc2c1=O.Cc1cn(CCO)c2ccccc2c1=O
InChIInChI=1S/C14H16N2O2.C13H14N2O2.C13H15NO2.C12H12N2O2.C12H11NO3.C12H13NO2.C11H11NO.C10H9NO.2C9H8N2O.C8H7N3O.C7H9NO.C6H7NO/c1-10-8-16(9-13(17)15(2)3)12-7-5-4-6-11(12)14(10)18;1-9-7-15(8-12(16)14-2)11-6-4-3-5-10(11)13(9)17;1-10-9-14(7-8-16-2)12-6-4-3-5-11(12)13(10)15;1-8-6-14(7-11(13)15)10-5-3-2-4-9(10)12(8)16;1-8-6-13(7-11(14)15)10-5-3-2-4-9(10)12(8)16;1-9-8-13(6-7-14)11-5-3-2-4-10(11)12(9)15;1-8-7-12-10-6-4-3-5-9(10)11(8)13-2;1-7-6-11-9-5-3-2-4-8(9)10(7)12;1-6-4-11-8-5-10-3-2-7(8)9(6)12;1-6-5-11-9-7(8(6)12)3-2-4-10-9;1-5-2-10-8-6(7(5)12)3-9-4-11-8;1-6-5-8(2)4-3-7(6)9;1-5-4-7-3-2-6(5)8/h4-8H,9H2,1-3H3;3-7H,8H2,1-2H3,(H,14,16);3-6,9H,7-8H2,1-2H3;2-6H,7H2,1H3,(H2,13,15);2-6H,7H2,1H3,(H,14,15);2-5,8,14H,6-7H2,1H3;3-7H,1-2H3;2-6H,1H3,(H,11,12);2-5H,1H3,(H,11,12);2-5H,1H3,(H,10,11,12);2-4H,1H3,(H,9,10,11,12);3-5H,1-2H3;2-4H,1H3,(H,7,8)
InChIKeySYADNVPPFDNUGH-UHFFFAOYSA-N
MW2374.74 g/mol
LogP16.76
Rot. Bonds14

About N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one

N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one (PubChem CID 160969076) has the molecular formula C136H140N20O20 and a molecular weight of 2374.74 g/mol. Its IUPAC name is N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one.

Molecular Properties

Compound NameN,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one
PubChem CID160969076
Molecular FormulaC136H140N20O20
Molecular Weight2374.74 g/mol
Exact Mass2373.06
IUPAC NameN,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one
SMILESCNC(=O)Cn1cc(C)c(=O)c2ccccc21.COCCn1cc(C)c(=O)c2ccccc21.COc1c(C)cnc2ccccc12.Cc1c[nH]c2ccccc2c1=O.Cc1c[nH]c2cnccc2c1=O.Cc1c[nH]c2ncccc2c1=O.Cc1c[nH]c2ncncc2c1=O.Cc1c[nH]ccc1=O.Cc1cn(C)ccc1=O.Cc1cn(CC(=O)N(C)C)c2ccccc2c1=O.Cc1cn(CC(=O)O)c2ccccc2c1=O.Cc1cn(CC(N)=O)c2ccccc2c1=O.Cc1cn(CCO)c2ccccc2c1=O
InChIInChI=1S/C14H16N2O2.C13H14N2O2.C13H15NO2.C12H12N2O2.C12H11NO3.C12H13NO2.C11H11NO.C10H9NO.2C9H8N2O.C8H7N3O.C7H9NO.C6H7NO/c1-10-8-16(9-13(17)15(2)3)12-7-5-4-6-11(12)14(10)18;1-9-7-15(8-12(16)14-2)11-6-4-3-5-10(11)13(9)17;1-10-9-14(7-8-16-2)12-6-4-3-5-11(12)13(10)15;1-8-6-14(7-11(13)15)10-5-3-2-4-9(10)12(8)16;1-8-6-13(7-11(14)15)10-5-3-2-4-9(10)12(8)16;1-9-8-13(6-7-14)11-5-3-2-4-10(11)12(9)15;1-8-7-12-10-6-4-3-5-9(10)11(8)13-2;1-7-6-11-9-5-3-2-4-8(9)10(7)12;1-6-4-11-8-5-10-3-2-7(8)9(6)12;1-6-5-11-9-7(8(6)12)3-2-4-10-9;1-5-2-10-8-6(7(5)12)3-9-4-11-8;1-6-5-8(2)4-3-7(6)9;1-5-4-7-3-2-6(5)8/h4-8H,9H2,1-3H3;3-7H,8H2,1-2H3,(H,14,16);3-6,9H,7-8H2,1-2H3;2-6H,7H2,1H3,(H2,13,15);2-6H,7H2,1H3,(H,14,15);2-5,8,14H,6-7H2,1H3;3-7H,1-2H3;2-6H,1H3,(H,11,12);2-5H,1H3,(H,11,12);2-5H,1H3,(H,10,11,12);2-4H,1H3,(H,9,10,11,12);3-5H,1-2H3;2-4H,1H3,(H,7,8)
InChIKeySYADNVPPFDNUGH-UHFFFAOYSA-N
XLogP16.76
TPSA551.24 Ų
H-Bond Donors9
H-Bond Acceptors31
Rotatable Bonds14
Heavy Atoms176
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002374.74
LogP ≤ 516.76
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1031

Analyze N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-{5-Fluoro-2-[6-(4-hydroxy-4-methyl-1-piperidyl)-5-methoxy-3-pyridylamino]-4-pyrimidinylamino}-2-quinolinecarboxamide
CID 176369132
N-(2-fluoro-3-hydroxy-3-methylbutyl)-4-[[2-[[5-[(2-fluoro-3-hydroxy-3-methylbutyl)carbamoyl]-4-[(2-fluoro-2-methylpropyl)amino]-2-pyridinyl]-quinolin-6-ylamino]cyclopropyl]amino]-6-[(4-methoxyquinazolin-6-yl)amino]pyridine-3-carboxamide
CID 123201125
N-ethyl-4-[[(1S)-1-[8-(2-methoxy-4-pyridinyl)-1-oxo-2-phenylisoquinolin-3-yl]ethyl]amino]-2-methylpyrimidine-5-carboxamide;N-(2-hydroxyethyl)-2-methyl-4-[[(1S)-1-[8-(2-methyl-4-pyridinyl)-1-oxo-2-phenylisoquinolin-3-yl]ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenyl-8-[5-(trifluoromethoxy)-3-pyridinyl]isoquinolin-1-one;methane;8-(2-methoxy-4-pyridinyl)-3-[(1S)-1-[(2-methyl-5-pyridin-2-ylpyrimidin-4-yl)amino]ethyl]-2-phenylisoquinolin-1-one
CID 157126534
deuterioethane;3-[6-[(3S,5R)-3,5-dimethyl-4-propanoylpiperazin-1-yl]-3-pyridinyl]-8-(4-isocyanophenyl)-1H-quinolin-4-one;1-[(2S,6R)-4-[5-[8-(4-isocyanophenyl)-4-methoxyquinolin-3-yl]-2-pyridinyl]-2,6-dimethylpiperazin-1-yl]propan-1-one;2,2,2-trifluoroacetic acid
CID 158867686
6-(2-hydroxyethylamino)-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxypropylamino)-5-(6-methoxy-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxypropylamino)-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxypropylamino)-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxypropylamino)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[3-hydroxypropyl(methyl)amino]-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[3-hydroxypropyl(methyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 158977972
4-N-[(4-aminocyclohexyl)methyl]-5-nitro-2-N-(quinolin-4-ylmethyl)pyrimidine-2,4-diamine;(2S)-2-[[4-[[[5-nitro-2-[[2-(trifluoromethoxy)phenyl]methylamino]pyrimidin-4-yl]amino]methyl]cyclohexyl]amino]-2-phenylethanol;bis(2-[[4-[[[5-nitro-2-[[2-(trifluoromethoxy)phenyl]methylamino]pyrimidin-4-yl]amino]methyl]cyclohexyl]amino]-1-phenylethanone)
CID 160756491
4-anilino-6-(ethylcarbamoylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide;ethyl (E)-3-[4-[[4-anilino-6-(ethylcarbamoylamino)pyridine-3-carbonyl]amino]phenyl]prop-2-enoate;6-(ethylcarbamoylamino)-4-(4-methoxyanilino)-N-pyridin-3-ylpyridine-3-carboxamide;6-(2-oxopentyl)-N-phenyl-4-(pyridin-3-ylamino)pyridine-3-carboxamide
CID 160829058
N-ethyl-4-[[(1S)-1-[8-(2-methoxy-4-pyridinyl)-1-oxo-2-phenylisoquinolin-3-yl]ethyl]amino]-2-methylpyrimidine-5-carboxamide;N-(2-hydroxyethyl)-2-methyl-4-[[(1S)-1-[8-(2-methyl-4-pyridinyl)-1-oxo-2-phenylisoquinolin-3-yl]ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(5-isocyano-2-methylpyrimidin-4-yl)amino]ethyl]-2-phenyl-8-[5-(trifluoromethoxy)-3-pyridinyl]isoquinolin-1-one
CID 161287630
2-fluoro-6-methyl-N-[1-[8-(1-methyl-2,4-dioxopyrimido[4,5-d]pyrimidin-3-yl)quinolin-5-yl]-3-oxobutan-2-yl]-4-[3-(trifluoromethyl)morpholin-4-yl]benzamide;phenyl 2-[[2-fluoro-6-methyl-4-[3-(trifluoromethyl)morpholin-4-yl]benzoyl]amino]-3-[8-(1-methyl-2,4-dioxopyrido[3,4-d]pyrimidin-3-yl)quinolin-5-yl]propanoate
CID 161421891
6-(3-hydroxypropylamino)-5-(6-methoxy-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxypropylamino)-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-hydroxypropylamino)-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[3-hydroxypropyl(methyl)amino]-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[3-hydroxypropyl(methyl)amino]-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[3-hydroxypropyl(methyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 161465386
methane;methyl (2S)-2-[[2,6-difluoro-4-[(3R)-3-(trifluoromethyl)morpholin-4-yl]benzoyl]amino]-3-[3-(dimethylamino)-8-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)-3-pyridinyl]quinolin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[(3R)-3-(trifluoromethyl)morpholin-4-yl]benzoyl]amino]-3-[8-(4-methoxy-6-methylpyrimidin-2-yl)quinolin-5-yl]propanoate;methyl (2S)-2-[[2,6-difluoro-4-[(3R)-3-(trifluoromethyl)morpholin-4-yl]benzoyl]amino]-3-[8-[1-methyl-2-oxo-5-(trifluoromethyl)-3-pyridinyl]quinolin-5-yl]propanoate
CID 162061467
2-[5-[[1-[5-[4-[[6-[[4-[3-(5-Fluoropyrimidin-2-yl)-2-methoxyanilino]-5-(methylcarbamoyl)-2-pyridinyl]amino]pyridine-3-carbonyl]amino]butyl]-3-pyridinyl]piperidine-3-carbonyl]amino]-2-oxo-1-pyridinyl]acetic acid
CID 176629332

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one?
The IUPAC name of N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one (CID 160969076) is N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one.
What is the SMILES notation for N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one?
The canonical SMILES for N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one is CNC(=O)Cn1cc(C)c(=O)c2ccccc21.COCCn1cc(C)c(=O)c2ccccc21.COc1c(C)cnc2ccccc12.Cc1c[nH]c2ccccc2c1=O.Cc1c[nH]c2cnccc2c1=O.Cc1c[nH]c2ncccc2c1=O.Cc1c[nH]c2ncncc2c1=O.Cc1c[nH]ccc1=O.Cc1cn(C)ccc1=O.Cc1cn(CC(=O)N(C)C)c2ccccc2c1=O.Cc1cn(CC(=O)O)c2ccccc2c1=O.Cc1cn(CC(N)=O)c2ccccc2c1=O.Cc1cn(CCO)c2ccccc2c1=O.
What is the InChIKey of N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one?
The InChIKey is SYADNVPPFDNUGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2.C13H14N2O2.C13H15NO2.C12H12N2O2.C12H11NO3.C12H13NO2.C11H11NO.C10H9NO.2C9H8N2O.C8H7N3O.C7H9NO.C6H7NO/c1-10-8-16(9-13(17)15(2)3)12-7-5-4-6-11(12)14(10)18;1-9-7-15(8-12(16)14-2)11-6-4-3-5-10(11)13(9)17;1-10-9-14(7-8-16-2)12-6-4-3-5-11(12)13(10)15;1-8-6-14(7-11(13)15)10-5-3-2-4-9(10)12(8)16;1-8-6-13(7-11(14)15)10-5-3-2-4-9(10)12(8)16;1-9-8-13(6-7-14)11-5-3-2-4-10(11)12(9)15;1-8-7-12-10-6-4-3-5-9(10)11(8)13-2;1-7-6-11-9-5-3-2-4-8(9)10(7)12;1-6-4-11-8-5-10-3-2-7(8)9(6)12;1-6-5-11-9-7(8(6)12)3-2-4-10-9;1-5-2-10-8-6(7(5)12)3-9-4-11-8;1-6-5-8(2)4-3-7(6)9;1-5-4-7-3-2-6(5)8/h4-8H,9H2,1-3H3;3-7H,8H2,1-2H3,(H,14,16);3-6,9H,7-8H2,1-2H3;2-6H,7H2,1H3,(H2,13,15);2-6H,7H2,1H3,(H,14,15);2-5,8,14H,6-7H2,1H3;3-7H,1-2H3;2-6H,1H3,(H,11,12);2-5H,1H3,(H,11,12);2-5H,1H3,(H,10,11,12);2-4H,1H3,(H,9,10,11,12);3-5H,1-2H3;2-4H,1H3,(H,7,8).
What are the key properties of N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one?
N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one has a molecular weight of 2374.74 g/mol, XLogP of 16.76, 14 rotatable bonds, 9 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;1,3-dimethylpyridin-4-one;1-(2-hydroxyethyl)-3-methylquinolin-4-one;1-(2-methoxyethyl)-3-methylquinolin-4-one;4-methoxy-3-methylquinoline;N-methyl-2-(3-methyl-4-oxoquinolin-1-yl)acetamide;3-methyl-1H-1,7-naphthyridin-4-one;3-methyl-1H-1,8-naphthyridin-4-one;2-(3-methyl-4-oxoquinolin-1-yl)acetamide;2-(3-methyl-4-oxoquinolin-1-yl)acetic acid;3-methyl-1H-pyridin-4-one;6-methyl-8H-pyrido[2,3-d]pyrimidin-5-one;3-methyl-1H-quinolin-4-one is sourced from PubChem (CID 160969076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).