3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole

C187H242F3N23O7 — CID 159729492

IUPAC3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole
SMILESCC(C)C1C(=O)N(C)c2ccccc21.CC(C)C1C(=O)Nc2ccccc21.CC(C)c1c(C#N)[nH]c2ccccc12.CC(C)c1c(C(F)(F)F)[nH]c2ccccc12.CC(C)c1cccc2c1CCCN2C.CC(C)c1cccc2c1OCCN2C.CC(C)c1ccnc2c1CCCC2.CC(C)c1ccnc2c1CCCN2.CC(C)c1ccnc2c1CCCN2C.CC(C)c1ccnc2c1OCCN2C.CC(C)c1cncc2ccccc12.CC(C)n1c(N)nc2ccccc21.CCc1noc(CC)c1C(C)C.COc1cc(C(C)C)c2ccccc2n1.Cc1nc2ccccn2c1C(C)C.Cc1noc(-c2ccccc2)c1C(C)C
InChIInChI=1S/2C13H15NO.C13H19N.C12H12F3N.C12H18N2.C12H12N2.C12H17NO.C12H15NO.C12H13N.C12H17N.C11H16N2O.C11H14N2.C11H16N2.C11H13NO.C10H13N3.C10H17NO/c1-9(2)11-8-13(15-3)14-12-7-5-4-6-10(11)12;1-9(2)12-10(3)14-15-13(12)11-7-5-4-6-8-11;1-10(2)11-6-4-8-13-12(11)7-5-9-14(13)3;1-7(2)10-8-5-3-4-6-9(8)16-11(10)12(13,14)15;1-9(2)10-6-7-13-12-11(10)5-4-8-14(12)3;1-8(2)12-9-5-3-4-6-10(9)14-11(12)7-13;1-9(2)10-5-4-6-11-12(10)14-8-7-13(11)3;1-8(2)11-9-6-4-5-7-10(9)13(3)12(11)14;1-9(2)12-8-13-7-10-5-3-4-6-11(10)12;1-9(2)10-7-8-13-12-6-4-3-5-11(10)12;1-8(2)9-4-5-12-11-10(9)14-7-6-13(11)3;1-8(2)11-9(3)12-10-6-4-5-7-13(10)11;1-8(2)9-5-7-13-11-10(9)4-3-6-12-11;1-7(2)10-8-5-3-4-6-9(8)12-11(10)13;1-7(2)13-9-6-4-3-5-8(9)12-10(13)11;1-5-8-10(7(3)4)9(6-2)12-11-8/h2*4-9H,1-3H3;4,6,8,10H,5,7,9H2,1-3H3;3-7,16H,1-2H3;6-7,9H,4-5,8H2,1-3H3;3-6,8,14H,1-2H3;4-6,9H,7-8H2,1-3H3;4-8,11H,1-3H3;3-9H,1-2H3;7-9H,3-6H2,1-2H3;4-5,8H,6-7H2,1-3H3;4-8H,1-3H3;5,7-8H,3-4,6H2,1-2H3,(H,12,13);3-7,10H,1-2H3,(H,12,13);3-7H,1-2H3,(H2,11,12);7H,5-6H2,1-4H3
InChIKeyNBBDEUONCIHKIU-UHFFFAOYSA-N
MW2981.14 g/mol
LogP46.74
Rot. Bonds20

About 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole

3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole (PubChem CID 159729492) has the molecular formula C187H242F3N23O7 and a molecular weight of 2981.14 g/mol. Its IUPAC name is 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole.

Molecular Properties

Compound Name3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole
PubChem CID159729492
Molecular FormulaC187H242F3N23O7
Molecular Weight2981.14 g/mol
Exact Mass2978.92
IUPAC Name3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole
SMILESCC(C)C1C(=O)N(C)c2ccccc21.CC(C)C1C(=O)Nc2ccccc21.CC(C)c1c(C#N)[nH]c2ccccc12.CC(C)c1c(C(F)(F)F)[nH]c2ccccc12.CC(C)c1cccc2c1CCCN2C.CC(C)c1cccc2c1OCCN2C.CC(C)c1ccnc2c1CCCC2.CC(C)c1ccnc2c1CCCN2.CC(C)c1ccnc2c1CCCN2C.CC(C)c1ccnc2c1OCCN2C.CC(C)c1cncc2ccccc12.CC(C)n1c(N)nc2ccccc21.CCc1noc(CC)c1C(C)C.COc1cc(C(C)C)c2ccccc2n1.Cc1nc2ccccn2c1C(C)C.Cc1noc(-c2ccccc2)c1C(C)C
InChIInChI=1S/2C13H15NO.C13H19N.C12H12F3N.C12H18N2.C12H12N2.C12H17NO.C12H15NO.C12H13N.C12H17N.C11H16N2O.C11H14N2.C11H16N2.C11H13NO.C10H13N3.C10H17NO/c1-9(2)11-8-13(15-3)14-12-7-5-4-6-10(11)12;1-9(2)12-10(3)14-15-13(12)11-7-5-4-6-8-11;1-10(2)11-6-4-8-13-12(11)7-5-9-14(13)3;1-7(2)10-8-5-3-4-6-9(8)16-11(10)12(13,14)15;1-9(2)10-6-7-13-12-11(10)5-4-8-14(12)3;1-8(2)12-9-5-3-4-6-10(9)14-11(12)7-13;1-9(2)10-5-4-6-11-12(10)14-8-7-13(11)3;1-8(2)11-9-6-4-5-7-10(9)13(3)12(11)14;1-9(2)12-8-13-7-10-5-3-4-6-11(10)12;1-9(2)10-7-8-13-12-6-4-3-5-11(10)12;1-8(2)9-4-5-12-11-10(9)14-7-6-13(11)3;1-8(2)11-9(3)12-10-6-4-5-7-13(10)11;1-8(2)9-5-7-13-11-10(9)4-3-6-12-11;1-7(2)10-8-5-3-4-6-9(8)12-11(10)13;1-7(2)13-9-6-4-3-5-8(9)12-10(13)11;1-5-8-10(7(3)4)9(6-2)12-11-8/h2*4-9H,1-3H3;4,6,8,10H,5,7,9H2,1-3H3;3-7,16H,1-2H3;6-7,9H,4-5,8H2,1-3H3;3-6,8,14H,1-2H3;4-6,9H,7-8H2,1-3H3;4-8,11H,1-3H3;3-9H,1-2H3;7-9H,3-6H2,1-2H3;4-5,8H,6-7H2,1-3H3;4-8H,1-3H3;5,7-8H,3-4,6H2,1-2H3,(H,12,13);3-7,10H,1-2H3,(H,12,13);3-7H,1-2H3,(H2,11,12);7H,5-6H2,1-4H3
InChIKeyNBBDEUONCIHKIU-UHFFFAOYSA-N
XLogP46.74
TPSA348.00 Ų
H-Bond Donors5
H-Bond Acceptors26
Rotatable Bonds20
Heavy Atoms220
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002981.14
LogP ≤ 546.74
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1026

Analyze 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole with MolForge

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Launch Full Analysis

Related Compounds

(4R)-4-[(1R)-1-[7-(3-methylbenzimidazol-5-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one;2-[[7-(3-methylbenzimidazol-5-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-(3-methylimidazo[4,5-b]pyridin-6-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;2-[[7-[4-[1-(4-methylpiperazin-1-yl)ethenyl]phenyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;(4R)-4-[(1R)-1-[7-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-6-yl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 157750123
3-[4-(5-cyano-3-pyridinyl)triazol-1-yl]-N-[4-fluoro-3-(3-methylbutyl)-5-(trifluoromethyl)phenyl]-4-methylbenzamide;N-[3-[(dimethylamino)methyl]-2-methoxy-5-(trifluoromethyl)phenyl]-4-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)triazol-1-yl]benzamide;N-[2-methoxy-3-[[methyl(propan-2-yl)amino]methyl]-5-(trifluoromethyl)phenyl]-4-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)triazol-1-yl]benzamide;N-[2-methoxy-3-(pyrrolidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]-4-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-5-yl)triazol-1-yl]benzamide;4-methyl-3-[4-(5-morpholin-4-yl-3-pyridinyl)triazol-1-yl]-N-[3-(pyrrolidin-1-ylmethyl)-5-(trifluoromethyl)phenyl]benzamide
CID 157787399
(1R,5S)-N-[2-(1,2-benzoxazol-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1-benzylindazol-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[1-(1-chloroisoquinolin-4-yl)oxy-2-methylpropan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1R,5S)-N-[2-(1-methylimidazo[1,5-a]pyridin-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1S,5R)-N-[2-(1-methylindazol-3-yl)propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1R,5S)-N-[2-methyl-1-[(2-methyl-3-pyridinyl)oxy]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1R,5S)-N-[2-methyl-1-[4-(trifluoromethyl)pyridazin-3-yl]oxypropan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide;(1R,5S)-N-[2-methyl-1-[[3-(trifluoromethyl)-2-pyridinyl]oxy]propan-2-yl]-3-azabicyclo[3.1.0]hexane-6-carboxamide
CID 157987542
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-6,12-dimorpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158180516
6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-(2-phenoxyethyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile;6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolo[3,2-d]pyrimidine-7-carbonitrile;6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-(quinolin-8-ylmethyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile;6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-(2,2,2-trifluoroethyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile;5-benzyl-6-(1,4-diazepan-1-yl)-3-methyl-4-oxopyrrolo[3,2-d]pyrimidine-7-carbonitrile;5-benzyl-3-methyl-4-oxo-6-piperazin-1-ylpyrrolo[3,2-d]pyrimidine-7-carbonitrile
CID 158403791
12-[(4,4-difluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;12-[(4-fluoropiperidin-1-yl)methyl]-4-(1H-indol-4-yl)-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-12-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;4-(1H-indol-4-yl)-11-methyl-6-morpholin-4-yl-8-oxa-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
CID 158885713
6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-(2-phenoxyethyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile;6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-[(3-phenyl-1,2-oxazol-5-yl)methyl]pyrrolo[3,2-d]pyrimidine-7-carbonitrile;6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-(quinolin-8-ylmethyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile;6-[(3S)-3-aminopiperidin-1-yl]-5-benzyl-4-oxo-3-(2,2,2-trifluoroethyl)pyrrolo[3,2-d]pyrimidine-7-carbonitrile;5-benzyl-3-methyl-4-oxo-6-piperazin-1-ylpyrrolo[3,2-d]pyrimidine-7-carbonitrile
CID 159388870
6-Ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 159510778
2-[[7-[6-(2,2-difluoropropoxy)-3-pyridinyl]quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;(4R)-4-[(1R)-1-[7-(2,4-dimethylquinazolin-6-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one;(4R)-4-[(1R)-1-[7-(2-methyl-3H-benzimidazol-5-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one;2-[[7-(2-methyl-3H-benzimidazol-5-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;(4R)-4-[(1R)-1-[7-[6-(2,2,2-trifluoroethoxy)-3-pyridinyl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one
CID 159583714
(4R)-4-[(1R)-1-[7-[6-(difluoromethoxy)-3-pyridinyl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one;(4R)-4-[(1R)-1-[7-(1,2-dimethylbenzimidazol-5-yl)quinolin-5-yl]oxyethyl]pyrrolidin-2-one;2-[[7-(1,2-dimethylbenzimidazol-5-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide;(4R)-4-[(1R)-1-[7-[3-methoxy-4-(trifluoromethyl)phenyl]quinolin-5-yl]oxyethyl]pyrrolidin-2-one;2-[[7-(3-methyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)quinolin-5-yl]oxymethyl]pyridine-3-carboxamide
CID 159911479
6-Ethoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;1-ethyl-6-fluoro-3-propan-2-ylindazole;5-fluoro-1,3-di(propan-2-yl)indazole;6-fluoro-1-(oxetan-3-yl)-3-propan-2-ylindazole;6-fluoro-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methoxy-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;6-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;7-methyl-3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-1,2-benzoxazole;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carbonitrile;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-6-carboxamide;3-propan-2-yl-[1,2,4]triazolo[4,3-a]pyridine-7-carboxamide;3-propan-2-yl-6-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine;3-propan-2-yl-7-(trifluoromethyl)-[1,2,4]triazolo[4,3-a]pyridine
CID 160464258
6-[[(2S)-1-amino-1-oxopropan-2-yl]amino]-2-[1-(2-methylpropyl)indol-5-yl]pyrimidine-4-carboxamide;1-[6-(3-methoxy-1H-indol-5-yl)-2-pyridinyl]-2-[4-(trifluoromethyl)phenyl]ethanone;2-[1-(4-methylphenyl)benzimidazol-5-yl]-6-[(2-oxopyrrolidin-3-yl)amino]pyrimidine-4-carboxamide;2-[3-(4-methylphenyl)benzimidazol-5-yl]-6-[(2-oxopyrrolidin-3-yl)amino]pyrimidine-4-carboxamide;6-[1-(2-methylpropyl)indol-5-yl]pyridine-2-carbaldehyde
CID 160728328

Frequently Asked Questions

What is the IUPAC name of 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole?
The IUPAC name of 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole (CID 159729492) is 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole.
What is the SMILES notation for 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole?
The canonical SMILES for 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole is CC(C)C1C(=O)N(C)c2ccccc21.CC(C)C1C(=O)Nc2ccccc21.CC(C)c1c(C#N)[nH]c2ccccc12.CC(C)c1c(C(F)(F)F)[nH]c2ccccc12.CC(C)c1cccc2c1CCCN2C.CC(C)c1cccc2c1OCCN2C.CC(C)c1ccnc2c1CCCC2.CC(C)c1ccnc2c1CCCN2.CC(C)c1ccnc2c1CCCN2C.CC(C)c1ccnc2c1OCCN2C.CC(C)c1cncc2ccccc12.CC(C)n1c(N)nc2ccccc21.CCc1noc(CC)c1C(C)C.COc1cc(C(C)C)c2ccccc2n1.Cc1nc2ccccn2c1C(C)C.Cc1noc(-c2ccccc2)c1C(C)C.
What is the InChIKey of 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole?
The InChIKey is NBBDEUONCIHKIU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H15NO.C13H19N.C12H12F3N.C12H18N2.C12H12N2.C12H17NO.C12H15NO.C12H13N.C12H17N.C11H16N2O.C11H14N2.C11H16N2.C11H13NO.C10H13N3.C10H17NO/c1-9(2)11-8-13(15-3)14-12-7-5-4-6-10(11)12;1-9(2)12-10(3)14-15-13(12)11-7-5-4-6-8-11;1-10(2)11-6-4-8-13-12(11)7-5-9-14(13)3;1-7(2)10-8-5-3-4-6-9(8)16-11(10)12(13,14)15;1-9(2)10-6-7-13-12-11(10)5-4-8-14(12)3;1-8(2)12-9-5-3-4-6-10(9)14-11(12)7-13;1-9(2)10-5-4-6-11-12(10)14-8-7-13(11)3;1-8(2)11-9-6-4-5-7-10(9)13(3)12(11)14;1-9(2)12-8-13-7-10-5-3-4-6-11(10)12;1-9(2)10-7-8-13-12-6-4-3-5-11(10)12;1-8(2)9-4-5-12-11-10(9)14-7-6-13(11)3;1-8(2)11-9(3)12-10-6-4-5-7-13(10)11;1-8(2)9-5-7-13-11-10(9)4-3-6-12-11;1-7(2)10-8-5-3-4-6-9(8)12-11(10)13;1-7(2)13-9-6-4-3-5-8(9)12-10(13)11;1-5-8-10(7(3)4)9(6-2)12-11-8/h2*4-9H,1-3H3;4,6,8,10H,5,7,9H2,1-3H3;3-7,16H,1-2H3;6-7,9H,4-5,8H2,1-3H3;3-6,8,14H,1-2H3;4-6,9H,7-8H2,1-3H3;4-8,11H,1-3H3;3-9H,1-2H3;7-9H,3-6H2,1-2H3;4-5,8H,6-7H2,1-3H3;4-8H,1-3H3;5,7-8H,3-4,6H2,1-2H3,(H,12,13);3-7,10H,1-2H3,(H,12,13);3-7H,1-2H3,(H2,11,12);7H,5-6H2,1-4H3.
What are the key properties of 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole?
3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole has a molecular weight of 2981.14 g/mol, XLogP of 46.74, 20 rotatable bonds, 5 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diethyl-4-propan-2-yl-1,2-oxazole;2-methoxy-4-propan-2-ylquinoline;3-methyl-5-phenyl-4-propan-2-yl-1,2-oxazole;4-methyl-8-propan-2-yl-2,3-dihydro-1,4-benzoxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;4-methyl-8-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazine;1-methyl-5-propan-2-yl-3,4-dihydro-2H-quinoline;2-methyl-3-propan-2-ylimidazo[1,2-a]pyridine;1-methyl-3-propan-2-yl-3H-indol-2-one;1-propan-2-ylbenzimidazol-2-amine;3-propan-2-yl-1,3-dihydroindol-2-one;3-propan-2-yl-1H-indole-2-carbonitrile;4-propan-2-ylisoquinoline;5-propan-2-yl-1,2,3,4-tetrahydro-1,8-naphthyridine;4-propan-2-yl-5,6,7,8-tetrahydroquinoline;3-propan-2-yl-2-(trifluoromethyl)-1H-indole is sourced from PubChem (CID 159729492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).