2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine

C237H286F4N40O5 — CID 167600102

IUPAC2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine
SMILESC=C1CCc2cc(C(C)C)ccc2C1.CC(C)c1cc2nccnc2cc1F.CC(C)c1ccc(-c2cnco2)nc1.CC(C)c1ccc(C#N)nc1.CC(C)c1ccc2c(=O)[nH]cnc2c1.CC(C)c1ccc2c(c1)CNN(C)C2=O.CC(C)c1ccc2ccccc2n1.CC(C)c1ccc2nc(C(F)(F)F)cn2n1.CC(C)c1ccc2nccnc2c1.CC(C)c1ccc2nccnc2n1.CC(C)c1ccc2ncncc2c1.CC(C)c1cnc2nccnc2c1.COc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1C.Cc1cnc2ccc(C(C)C)cc2n1.Cc1cnc2ccc(C(C)C)nn12.Cc1nc2cc(C(C)C)ccc2c(=O)[nH]1.Cc1nc2ccc(C(C)C)cc2nc1C.Cc1ncc2cc(C(C)C)ccc2n1
InChIInChI=1S/C14H18.C13H16N2.C12H16N2O.C12H14N2O.2C12H14N2.C12H13N.C11H11FN2.2C11H12N2O.2C11H12N2.C10H10F3N3.C10H13N3.2C10H11N3.C10H15N.C9H10N2.C9H13NO.3C9H13N/c1-10(2)12-6-7-13-8-11(3)4-5-14(13)9-12;1-8(2)11-5-6-12-13(7-11)15-10(4)9(3)14-12;1-8(2)9-4-5-11-10(6-9)7-13-14(3)12(11)15;1-7(2)9-4-5-10-11(6-9)13-8(3)14-12(10)15;1-8(2)10-4-5-12-11(6-10)7-13-9(3)14-12;1-8(2)10-4-5-11-12(6-10)14-9(3)7-13-11;1-9(2)11-8-7-10-5-3-4-6-12(10)13-11;1-7(2)8-5-10-11(6-9(8)12)14-4-3-13-10;1-8(2)9-3-4-10(13-5-9)11-6-12-7-14-11;1-7(2)8-3-4-9-10(5-8)12-6-13-11(9)14;1-8(2)9-3-4-11-10(5-9)6-12-7-13-11;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;1-6(2)7-3-4-9-14-8(10(11,12)13)5-16(9)15-7;1-7(2)9-4-5-10-11-6-8(3)13(10)12-9;1-7(2)8-5-9-10(13-6-8)12-4-3-11-9;1-7(2)8-3-4-9-10(13-8)12-6-5-11-9;1-7(2)10-6-5-8(3)9(4)11-10;1-7(2)8-3-4-9(5-10)11-6-8;1-7(2)8-4-5-9(11-3)10-6-8;3*1-7(2)9-5-4-8(3)6-10-9/h6-7,9-10H,3-5,8H2,1-2H3;5-8H,1-4H3;4-6,8,13H,7H2,1-3H3;4-7H,1-3H3,(H,13,14,15);2*4-8H,1-3H3;3-9H,1-2H3;3-7H,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,12,13,14);2*3-8H,1-2H3;3-6H,1-2H3;4-7H,1-3H3;2*3-7H,1-2H3;5-7H,1-4H3;3-4,6-7H,1-2H3;4-7H,1-3H3;3*4-7H,1-3H3
InChIKeyJPKAOIMYVXTBMC-UHFFFAOYSA-N
MW3851.16 g/mol
LogP58.25
Rot. Bonds24

About 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine

2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine (PubChem CID 167600102) has the molecular formula C237H286F4N40O5 and a molecular weight of 3851.16 g/mol. Its IUPAC name is 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine.

Molecular Properties

Compound Name2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine
PubChem CID167600102
Molecular FormulaC237H286F4N40O5
Molecular Weight3851.16 g/mol
Exact Mass3848.33
IUPAC Name2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine
SMILESC=C1CCc2cc(C(C)C)ccc2C1.CC(C)c1cc2nccnc2cc1F.CC(C)c1ccc(-c2cnco2)nc1.CC(C)c1ccc(C#N)nc1.CC(C)c1ccc2c(=O)[nH]cnc2c1.CC(C)c1ccc2c(c1)CNN(C)C2=O.CC(C)c1ccc2ccccc2n1.CC(C)c1ccc2nc(C(F)(F)F)cn2n1.CC(C)c1ccc2nccnc2c1.CC(C)c1ccc2nccnc2n1.CC(C)c1ccc2ncncc2c1.CC(C)c1cnc2nccnc2c1.COc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1C.Cc1cnc2ccc(C(C)C)cc2n1.Cc1cnc2ccc(C(C)C)nn12.Cc1nc2cc(C(C)C)ccc2c(=O)[nH]1.Cc1nc2ccc(C(C)C)cc2nc1C.Cc1ncc2cc(C(C)C)ccc2n1
InChIInChI=1S/C14H18.C13H16N2.C12H16N2O.C12H14N2O.2C12H14N2.C12H13N.C11H11FN2.2C11H12N2O.2C11H12N2.C10H10F3N3.C10H13N3.2C10H11N3.C10H15N.C9H10N2.C9H13NO.3C9H13N/c1-10(2)12-6-7-13-8-11(3)4-5-14(13)9-12;1-8(2)11-5-6-12-13(7-11)15-10(4)9(3)14-12;1-8(2)9-4-5-11-10(6-9)7-13-14(3)12(11)15;1-7(2)9-4-5-10-11(6-9)13-8(3)14-12(10)15;1-8(2)10-4-5-12-11(6-10)7-13-9(3)14-12;1-8(2)10-4-5-11-12(6-10)14-9(3)7-13-11;1-9(2)11-8-7-10-5-3-4-6-12(10)13-11;1-7(2)8-5-10-11(6-9(8)12)14-4-3-13-10;1-8(2)9-3-4-10(13-5-9)11-6-12-7-14-11;1-7(2)8-3-4-9-10(5-8)12-6-13-11(9)14;1-8(2)9-3-4-11-10(5-9)6-12-7-13-11;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;1-6(2)7-3-4-9-14-8(10(11,12)13)5-16(9)15-7;1-7(2)9-4-5-10-11-6-8(3)13(10)12-9;1-7(2)8-5-9-10(13-6-8)12-4-3-11-9;1-7(2)8-3-4-9-10(13-8)12-6-5-11-9;1-7(2)10-6-5-8(3)9(4)11-10;1-7(2)8-3-4-9(5-10)11-6-8;1-7(2)8-4-5-9(11-3)10-6-8;3*1-7(2)9-5-4-8(3)6-10-9/h6-7,9-10H,3-5,8H2,1-2H3;5-8H,1-4H3;4-6,8,13H,7H2,1-3H3;4-7H,1-3H3,(H,13,14,15);2*4-8H,1-3H3;3-9H,1-2H3;3-7H,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,12,13,14);2*3-8H,1-2H3;3-6H,1-2H3;4-7H,1-3H3;2*3-7H,1-2H3;5-7H,1-4H3;3-4,6-7H,1-2H3;4-7H,1-3H3;3*4-7H,1-3H3
InChIKeyJPKAOIMYVXTBMC-UHFFFAOYSA-N
XLogP58.25
TPSA578.41 Ų
H-Bond Donors3
H-Bond Acceptors42
Rotatable Bonds24
Heavy Atoms286
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003851.16
LogP ≤ 558.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1042

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine with MolForge

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Related Compounds

[2-[4-[[2-[(1,3-Benzoxazol-2-ylamino)methyl]-1-[3-methyl-2-(triazol-2-yl)benzoyl]piperidin-3-yl]methyl]pyrimidin-2-yl]-4-methylphenyl]-[2-[[(6-fluoro-1,3-benzoxazol-2-yl)amino]methyl]-3-methylpiperidin-1-yl]methanone
CID 123179954
[2-[[(5-Fluoro-1,3-benzoxazol-2-yl)amino]methyl]-3-methylpiperidin-1-yl]-[2-[4-[1-[5-fluoro-2-(triazol-2-yl)benzoyl]-3-methyl-2-[[[5-(trifluoromethyl)pyrimidin-2-yl]amino]methyl]piperidin-4-yl]pyrimidin-2-yl]-5-methylphenyl]methanone
CID 123937600
6-[7-(difluoromethyl)-1-[6-(methylcarbamoylamino)-2-pyridinyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-3-yl]-2-[6-[8-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-2-(methylcarbamoyl)quinolin-5-yl]-3-(1-methylpyrazol-4-yl)isoquinolin-8-yl]-N-methyl-1,3-benzoxazole-4-carboxamide
CID 132181505
[2-[4-[[(2S,3S)-2-[(1,3-benzoxazol-2-ylamino)methyl]-1-[3-methyl-2-(triazol-2-yl)benzoyl]piperidin-3-yl]methyl]pyrimidin-2-yl]-4-methylphenyl]-[(2S,3R)-2-[[(6-fluoro-1,3-benzoxazol-2-yl)amino]methyl]-3-methylpiperidin-1-yl]methanone
CID 144903062
CID 157119212
CID 157119212
1,5-di(propan-2-yl)benzotriazole;2-fluoro-4-propan-2-ylpyridine;3-fluoro-4-propan-2-ylpyridine;2-methoxy-3-propan-2-ylpyridine;2-methoxy-4-propan-2-ylpyridine;3-methoxy-4-propan-2-ylpyridine;3-methoxy-5-propan-2-ylpyridine;6-propan-2-yl-1H-benzimidazole;6-propan-2-yl-1,3-benzoxazole;5-propan-2-yl-1H-indazole;5-propan-2-yl-1H-indole;4-propan-2-yl-1H-pyrazole;5-propan-2-yl-1H-pyrazole;4-propan-2-ylpyridazine;3-propan-2-ylpyridine;4-propan-2-yl-1H-pyridin-2-one;5-propan-2-ylpyrimidine;3-propan-2-yl-1H-pyrrole;4-propan-2-yl-2H-triazole;1-propan-2-yl-2-(trifluoromethyl)benzene
CID 158433120
7-(2,7-dimethyl-3H-benzimidazol-5-yl)-5-fluoro-3-piperidin-4-yl-1,2,4-benzotriazine;5-fluoro-7-[2-methyl-8-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]-3-piperidin-4-yl-1,2,4-benzotriazine;6-(5-fluoro-3-piperidin-4-yl-1,2,4-benzotriazin-7-yl)-2,4-dimethyl-1,3-benzoxazole
CID 158781212
3-amino-N-[(1S)-1-[1-oxo-2-phenyl-8-(trifluoromethyl)isoquinolin-3-yl]ethyl]pyrazine-2-carboxamide;8-(2-methoxy-4-pyridinyl)-2-phenyl-3-[(1S)-1-(1-pyrazolo[1,5-a]pyrimidin-3-ylethenylamino)ethyl]isoquinolin-1-one;2-methyl-N-[(1S)-1-(4-oxo-3-phenylquinazolin-2-yl)ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
CID 159340376
N-[4-methyl-3-(1-methyl-7-morpholin-4-ylpyrazolo[4,5-d]pyrimidin-5-yl)phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-(4-morpholin-4-yl-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-(4-morpholin-4-ylfuro[3,2-d]pyrimidin-2-yl)phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-(8-morpholin-4-ylimidazo[1,2-b]pyridazin-6-yl)phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-(4-morpholin-4-ylpyrido[2,3-d]pyrimidin-2-yl)phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-(4-morpholin-4-yl-5,6,7,8-tetrahydropyrido[3,4-d]pyrimidin-2-yl)phenyl]-3-(trifluoromethyl)benzamide;N-[4-methyl-3-(4-morpholin-4-yl-5,6,7,8-tetrahydropyrido[4,3-d]pyrimidin-2-yl)phenyl]-3-(trifluoromethyl)benzamide;N-[6-methyl-5-[8-[2-(3H-pyrrol-2-yl)morpholin-4-yl]imidazo[1,2-b]pyridazin-6-yl]-3-pyridinyl]-3-(trifluoromethyl)benzamide
CID 159908285
2-chloro-6-fluoro-3-propan-2-ylpyridine;2-(1,1-dideuterioethyl)-5-propan-2-ylisoquinolin-1-one;2-(difluoromethyl)-5-propan-2-ylisoquinolin-1-one;2,5-di(propan-2-yl)isoquinolin-1-one;2-ethyl-5-propan-2-ylisoquinolin-1-one;2-(2-fluoropropyl)-5-propan-2-ylisoquinolin-1-one;6-methoxy-2-methyl-3-propan-2-ylpyridine;1-methyl-2-methylidene-5-propan-2-ylquinoline;1-methyl-7-propan-2-ylbenzimidazole;2-methyl-5-propan-2-yl-3,4-dihydroisoquinolin-1-one;2-methyl-5-propan-2-ylisoquinolin-1-one;4-methyl-5-propan-2-yl-1,3-oxazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-8-propan-2-ylquinazolin-4-one;5-propan-2-yl-3,4-dihydro-2H-naphthalen-1-one;5-propan-2-yl-2H-naphthalen-1-one;5-propan-2-yl-2-(2,2,2-trifluoroethyl)-3,4-dihydroisoquinolin-1-one
CID 160252553
6-(1,3-benzoxazol-7-yl)-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-8-methylimidazo[1,2-b]pyridazine-3-carboxamide;6-(1,3-benzoxazol-5-yl)-8-methyl-N-(1,1,1-trifluoropropan-2-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-(1,3-benzoxazol-7-yl)-8-methyl-N-(1,1,1-trifluoropropan-2-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-(2-cyano-4-fluorophenyl)-N-[(1S)-1-cyclopropylethyl]-8-methylimidazo[1,2-b]pyridazine-3-carboxamide;6-(2-cyano-4-fluorophenyl)-N-(1-cyclopropyl-2,2,2-trifluoroethyl)-8-methylimidazo[1,2-b]pyridazine-3-carboxamide;6-(2-cyano-4-fluorophenyl)-8-methyl-N-(1,1,1-trifluoropropan-2-yl)imidazo[1,2-b]pyridazine-3-carboxamide;6-(3-fluorophenyl)-8-methyl-N-(1,1,1-trifluoropropan-2-yl)imidazo[1,2-b]pyridazine-3-carboxamide
CID 164014775
2-(1,1-dideuterioethyl)-5-propan-2-ylisoquinolin-1-one;2-(2,2-difluoropropyl)-5-propan-2-yl-3,4-dihydroisoquinolin-1-one;2,5-di(propan-2-yl)isoquinolin-1-one;2-ethyl-5-propan-2-ylisoquinolin-1-one;2-(1-fluoroethyl)-5-propan-2-ylisoquinolin-1-one;2-(2-fluoropropyl)-5-propan-2-ylisoquinolin-1-one;6-methoxy-2-methyl-3-propan-2-ylpyridine;1-methyl-2-methylidene-5-propan-2-ylquinoline;1-methyl-7-propan-2-ylbenzimidazole;2-methyl-5-propan-2-yl-3,4-dihydroisoquinolin-1-one;1-methyl-7-propan-2-ylindazole;3-methyl-4-propan-2-yl-2H-indazole;2-methyl-5-propan-2-ylisoquinolin-1-one;4-methyl-5-propan-2-yl-1,3-oxazole;1-methyl-5-propan-2-ylpyrazole;3-methyl-8-propan-2-ylquinazolin-4-one;5-propan-2-yl-3,4-dihydro-2H-naphthalen-1-one;5-propan-2-yl-2H-naphthalen-1-one
CID 167635159

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine?
The IUPAC name of 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine (CID 167600102) is 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine.
What is the SMILES notation for 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine?
The canonical SMILES for 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine is C=C1CCc2cc(C(C)C)ccc2C1.CC(C)c1cc2nccnc2cc1F.CC(C)c1ccc(-c2cnco2)nc1.CC(C)c1ccc(C#N)nc1.CC(C)c1ccc2c(=O)[nH]cnc2c1.CC(C)c1ccc2c(c1)CNN(C)C2=O.CC(C)c1ccc2ccccc2n1.CC(C)c1ccc2nc(C(F)(F)F)cn2n1.CC(C)c1ccc2nccnc2c1.CC(C)c1ccc2nccnc2n1.CC(C)c1ccc2ncncc2c1.CC(C)c1cnc2nccnc2c1.COc1ccc(C(C)C)cn1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1.Cc1ccc(C(C)C)nc1C.Cc1cnc2ccc(C(C)C)cc2n1.Cc1cnc2ccc(C(C)C)nn12.Cc1nc2cc(C(C)C)ccc2c(=O)[nH]1.Cc1nc2ccc(C(C)C)cc2nc1C.Cc1ncc2cc(C(C)C)ccc2n1.
What is the InChIKey of 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine?
The InChIKey is JPKAOIMYVXTBMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18.C13H16N2.C12H16N2O.C12H14N2O.2C12H14N2.C12H13N.C11H11FN2.2C11H12N2O.2C11H12N2.C10H10F3N3.C10H13N3.2C10H11N3.C10H15N.C9H10N2.C9H13NO.3C9H13N/c1-10(2)12-6-7-13-8-11(3)4-5-14(13)9-12;1-8(2)11-5-6-12-13(7-11)15-10(4)9(3)14-12;1-8(2)9-4-5-11-10(6-9)7-13-14(3)12(11)15;1-7(2)9-4-5-10-11(6-9)13-8(3)14-12(10)15;1-8(2)10-4-5-12-11(6-10)7-13-9(3)14-12;1-8(2)10-4-5-11-12(6-10)14-9(3)7-13-11;1-9(2)11-8-7-10-5-3-4-6-12(10)13-11;1-7(2)8-5-10-11(6-9(8)12)14-4-3-13-10;1-8(2)9-3-4-10(13-5-9)11-6-12-7-14-11;1-7(2)8-3-4-9-10(5-8)12-6-13-11(9)14;1-8(2)9-3-4-11-10(5-9)6-12-7-13-11;1-8(2)9-3-4-10-11(7-9)13-6-5-12-10;1-6(2)7-3-4-9-14-8(10(11,12)13)5-16(9)15-7;1-7(2)9-4-5-10-11-6-8(3)13(10)12-9;1-7(2)8-5-9-10(13-6-8)12-4-3-11-9;1-7(2)8-3-4-9-10(13-8)12-6-5-11-9;1-7(2)10-6-5-8(3)9(4)11-10;1-7(2)8-3-4-9(5-10)11-6-8;1-7(2)8-4-5-9(11-3)10-6-8;3*1-7(2)9-5-4-8(3)6-10-9/h6-7,9-10H,3-5,8H2,1-2H3;5-8H,1-4H3;4-6,8,13H,7H2,1-3H3;4-7H,1-3H3,(H,13,14,15);2*4-8H,1-3H3;3-9H,1-2H3;3-7H,1-2H3;3-8H,1-2H3;3-7H,1-2H3,(H,12,13,14);2*3-8H,1-2H3;3-6H,1-2H3;4-7H,1-3H3;2*3-7H,1-2H3;5-7H,1-4H3;3-4,6-7H,1-2H3;4-7H,1-3H3;3*4-7H,1-3H3.
What are the key properties of 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine?
2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine has a molecular weight of 3851.16 g/mol, XLogP of 58.25, 24 rotatable bonds, 3 hydrogen bond donors, and 42 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-6-propan-2-ylpyridine;2,3-dimethyl-6-propan-2-ylquinoxaline;6-fluoro-7-propan-2-ylquinoxaline;2-methoxy-5-propan-2-ylpyridine;3-methylidene-7-propan-2-yl-2,4-dihydro-1H-naphthalene;2-methyl-6-propan-2-yl-3,4-dihydrophthalazin-1-one;3-methyl-6-propan-2-ylimidazo[1,2-b]pyridazine;tris(5-methyl-2-propan-2-ylpyridine);2-methyl-6-propan-2-ylquinazoline;2-methyl-7-propan-2-yl-3H-quinazolin-4-one;2-methyl-7-propan-2-ylquinoxaline;5-propan-2-ylpyridine-2-carbonitrile;5-(5-propan-2-yl-2-pyridinyl)-1,3-oxazole;6-propan-2-ylpyrido[2,3-b]pyrazine;7-propan-2-ylpyrido[2,3-b]pyrazine;6-propan-2-ylquinazoline;7-propan-2-yl-3H-quinazolin-4-one;2-propan-2-ylquinoline;6-propan-2-ylquinoxaline;6-propan-2-yl-2-(trifluoromethyl)imidazo[1,2-b]pyridazine is sourced from PubChem (CID 167600102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).