cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline

C191H272N24O — CID 157152840

IUPACcumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline
SMILESCC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCCc2cccnc21.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC(C)c1cccc2c1CC=C2.CC(C)c1cccc2c1CC=C2.CC(C)c1cccc2c1CC=N2.CC(C)c1cccc2ccccc12.CC(C)c1cccc2ncccc12.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1cncnc1.CC(C)n1ccc2ccccc21.CC(C)n1ccc2cccnc21.CC(C)n1cccc1.CC(C)n1cccn1.CC(C)n1ccnc1.CC(C)n1cnc2ccccc21
InChIInChI=1S/C13H14.C12H13N.2C12H14.C11H16N2.2C11H13N.2C10H12N2.C9H12.C8H18N2.2C8H11N.C8H17N.C8H11N.C7H10N2.C7H15NO.C7H15N.C7H11N.2C6H10N2/c1-10(2)12-9-5-7-11-6-3-4-8-13(11)12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;2*1-9(2)11-7-3-5-10-6-4-8-12(10)11;1-9(2)13-8-4-6-10-5-3-7-12-11(10)13;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-9(2)12-8-7-10-5-3-4-6-11(10)12;1-8(2)12-7-5-9-4-3-6-11-10(9)12;1-8(2)12-7-11-9-5-3-4-6-10(9)12;1-8(2)9-6-4-3-5-7-9;1-8(2)10-6-4-9(3)5-7-10;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-8(2)9-6-4-3-5-7-9;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-7(2)8-3-5-9-6-4-8;2*1-7(2)8-5-3-4-6-8;1-6(2)8-4-3-7-5-8;1-6(2)8-5-3-4-7-8/h3-10H,1-2H3;3-9H,1-2H3;2*3-7,9H,8H2,1-2H3;3,5,7,9H,4,6,8H2,1-2H3;3-5,7-8H,6H2,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;3-8H,1-2H3;8H,4-7H2,1-3H3;2*3-7H,1-2H3;8H,3-7H2,1-2H3;3-7H,1-2H3;3-6H,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3
InChIKeyALLNKSUVRONNSP-UHFFFAOYSA-N
MW2920.44 g/mol
LogP48.61
Rot. Bonds21

About cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline

cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline (PubChem CID 157152840) has the molecular formula C191H272N24O and a molecular weight of 2920.44 g/mol. Its IUPAC name is cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline.

Molecular Properties

Compound Namecumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline
PubChem CID157152840
Molecular FormulaC191H272N24O
Molecular Weight2920.44 g/mol
Exact Mass2918.20
IUPAC Namecumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline
SMILESCC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCCc2cccnc21.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC(C)c1cccc2c1CC=C2.CC(C)c1cccc2c1CC=C2.CC(C)c1cccc2c1CC=N2.CC(C)c1cccc2ccccc12.CC(C)c1cccc2ncccc12.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1cncnc1.CC(C)n1ccc2ccccc21.CC(C)n1ccc2cccnc21.CC(C)n1cccc1.CC(C)n1cccn1.CC(C)n1ccnc1.CC(C)n1cnc2ccccc21
InChIInChI=1S/C13H14.C12H13N.2C12H14.C11H16N2.2C11H13N.2C10H12N2.C9H12.C8H18N2.2C8H11N.C8H17N.C8H11N.C7H10N2.C7H15NO.C7H15N.C7H11N.2C6H10N2/c1-10(2)12-9-5-7-11-6-3-4-8-13(11)12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;2*1-9(2)11-7-3-5-10-6-4-8-12(10)11;1-9(2)13-8-4-6-10-5-3-7-12-11(10)13;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-9(2)12-8-7-10-5-3-4-6-11(10)12;1-8(2)12-7-5-9-4-3-6-11-10(9)12;1-8(2)12-7-11-9-5-3-4-6-10(9)12;1-8(2)9-6-4-3-5-7-9;1-8(2)10-6-4-9(3)5-7-10;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-8(2)9-6-4-3-5-7-9;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-7(2)8-3-5-9-6-4-8;2*1-7(2)8-5-3-4-6-8;1-6(2)8-4-3-7-5-8;1-6(2)8-5-3-4-7-8/h3-10H,1-2H3;3-9H,1-2H3;2*3-7,9H,8H2,1-2H3;3,5,7,9H,4,6,8H2,1-2H3;3-5,7-8H,6H2,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;3-8H,1-2H3;8H,4-7H2,1-3H3;2*3-7H,1-2H3;8H,3-7H2,1-2H3;3-7H,1-2H3;3-6H,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3
InChIKeyALLNKSUVRONNSP-UHFFFAOYSA-N
XLogP48.61
TPSA212.40 Ų
H-Bond Donors
H-Bond Acceptors25
Rotatable Bonds21
Heavy Atoms216
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002920.44
LogP ≤ 548.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1025

Analyze cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline with MolForge

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Related Compounds

7-[2-[5-[4-amino-5-(1-methylpyrazol-3-yl)pyrrolo[2,3-d]pyrimidin-7-yl]-3-pyridinyl]ethyl]-2-ethyl-N-(2-methoxyethyl)-N-methylquinolin-4-amine
CID 156303996
N-methyl-N-[[3-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]-8-morpholin-4-ylimidazo[1,2-b]pyridazin-2-yl]methyl]quinolin-2-amine
CID 117728306
4-[3-[5,7-difluoro-8-[[3-[1-(8-fluoroquinolin-4-yl)-2-methyl-6-morpholin-4-ylbenzimidazol-4-yl]-1H-1,2,4-triazol-5-yl]methyl]quinolin-4-yl]-2-methyl-7-(1H-1,2,4-triazol-5-yl)benzimidazol-5-yl]morpholine
CID 134382020
3-Fluoro-7-[3-[1-[[1-fluoro-2-[7-[3-[5-fluoro-1-[[1-fluoro-2-[6-[3-[5-fluoro-1-[[1-fluoro-2-[5-[3-[5-fluoro-1-[(1-fluorocyclopentyl)methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]benzimidazol-1-yl]cyclopentyl]methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]imidazo[4,5-b]pyridin-3-yl]cyclopentyl]methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]quinolin-4-yl]cyclopentyl]methyl]pyrazol-4-yl]-6-methyl-2-pyridinyl]quinoline
CID 137391920
1-[6-[[1-[5-[[7-[4-(4-chloro-1-methylimidazol-2-yl)phenyl]-1-(2-propan-2-yl-3-pyridinyl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]methyl]-2-propan-2-yl-3-pyridinyl]-7-[4-[1-(2-methoxyethyl)pyrazol-4-yl]phenyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazin-3-yl]methyl]-2-propan-2-yl-3-pyridinyl]-3,5-dimethyl-7-[4-[1-methyl-4-(trifluoromethyl)imidazol-2-yl]phenyl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 154970495
9-[[4-[4-(Azetidin-1-yl)-1-methylimidazol-2-yl]phenyl]methyl]-7-methyl-2-(2-propan-2-yl-3-pyridinyl)purin-8-one;bis(9-[[4-(3,5-dimethylpyrazol-1-yl)cyclohexyl]methyl]-7-methyl-2-(2-propan-2-ylphenyl)purin-8-one);methane;7-methyl-9-[[4-[1-(oxetan-3-yl)-4-(trifluoromethyl)imidazol-2-yl]phenyl]methyl]-2-(2-propan-2-ylphenyl)purin-8-one
CID 157096663
3-(3,3-difluorocyclobutyl)-1-[3-(1,3-dimethylpyrazol-4-yl)-7-methylisoquinolin-8-yl]-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide;3-(4,4-difluorocyclohexyl)-1-[3-(1,3-dimethylpyrazol-4-yl)isoquinolin-8-yl]-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide;3-(4,4-difluorocyclohexyl)-N-methyl-1-[2-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)quinolin-5-yl]-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 157312835
2-[3,5-Bis[3-(2-methylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(2-methylphenyl)imidazo[4,5-b]pyridine;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;iridium;2-[3-(trifluoromethyl)pyrazol-1-id-5-yl]pyridine
CID 157319134
3-(3,3-difluorocyclobutyl)-1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide;3-(4,4-difluorocyclohexyl)-1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide;3-(2,2-difluorocyclopropyl)-1-[3-(difluoromethyl)-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 157762464
1-[3-cyano-2-(1-methylpyrazol-4-yl)quinolin-5-yl]-3-(3,3-difluorocyclobutyl)-N-methyl-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide;3-(3,3-difluorocyclobutyl)-N-methyl-1-(3-morpholin-4-ylisoquinolin-8-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide;N-methyl-1-[2-(1-methylpyrazol-4-yl)-3-(trifluoromethyl)quinolin-5-yl]-3-(oxan-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine-7-carboxamide
CID 157854620
2-[2-(8-Chloro-5-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]-3-methylbenzo[e]benzimidazole;3-methyl-2-[2-[5-methyl-8-(trifluoromethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-yl]ethyl]benzo[e]benzimidazole;bis(3-methyl-2-[2-([1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]imidazo[4,5-h]quinoline);2-[2-(8-methyl-[1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]-[1,2,4]triazolo[5,1-a]isoquinoline;2-[2-([1,2,4]triazolo[1,5-a]pyridin-2-yl)ethyl]-[1,2,4]triazolo[1,5-h][1,7]naphthyridine
CID 157895805
CID 157964006
CID 157964006

Frequently Asked Questions

What is the IUPAC name of cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline?
The IUPAC name of cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline (CID 157152840) is cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline.
What is the SMILES notation for cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline?
The canonical SMILES for cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline is CC(C)N1CCCC1.CC(C)N1CCCCC1.CC(C)N1CCCc2cccnc21.CC(C)N1CCN(C)CC1.CC(C)N1CCOCC1.CC(C)c1cccc2c1CC=C2.CC(C)c1cccc2c1CC=C2.CC(C)c1cccc2c1CC=N2.CC(C)c1cccc2ccccc12.CC(C)c1cccc2ncccc12.CC(C)c1ccccc1.CC(C)c1ccccn1.CC(C)c1cccnc1.CC(C)c1ccncc1.CC(C)c1cncnc1.CC(C)n1ccc2ccccc21.CC(C)n1ccc2cccnc21.CC(C)n1cccc1.CC(C)n1cccn1.CC(C)n1ccnc1.CC(C)n1cnc2ccccc21.
What is the InChIKey of cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline?
The InChIKey is ALLNKSUVRONNSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14.C12H13N.2C12H14.C11H16N2.2C11H13N.2C10H12N2.C9H12.C8H18N2.2C8H11N.C8H17N.C8H11N.C7H10N2.C7H15NO.C7H15N.C7H11N.2C6H10N2/c1-10(2)12-9-5-7-11-6-3-4-8-13(11)12;1-9(2)10-5-3-7-12-11(10)6-4-8-13-12;2*1-9(2)11-7-3-5-10-6-4-8-12(10)11;1-9(2)13-8-4-6-10-5-3-7-12-11(10)13;1-8(2)9-4-3-5-11-10(9)6-7-12-11;1-9(2)12-8-7-10-5-3-4-6-11(10)12;1-8(2)12-7-5-9-4-3-6-11-10(9)12;1-8(2)12-7-11-9-5-3-4-6-10(9)12;1-8(2)9-6-4-3-5-7-9;1-8(2)10-6-4-9(3)5-7-10;1-7(2)8-3-5-9-6-4-8;1-7(2)8-4-3-5-9-6-8;1-8(2)9-6-4-3-5-7-9;1-7(2)8-5-3-4-6-9-8;1-6(2)7-3-8-5-9-4-7;1-7(2)8-3-5-9-6-4-8;2*1-7(2)8-5-3-4-6-8;1-6(2)8-4-3-7-5-8;1-6(2)8-5-3-4-7-8/h3-10H,1-2H3;3-9H,1-2H3;2*3-7,9H,8H2,1-2H3;3,5,7,9H,4,6,8H2,1-2H3;3-5,7-8H,6H2,1-2H3;3-9H,1-2H3;2*3-8H,1-2H3;3-8H,1-2H3;8H,4-7H2,1-3H3;2*3-7H,1-2H3;8H,3-7H2,1-2H3;3-7H,1-2H3;3-6H,1-2H3;7H,3-6H2,1-2H3;7H,3-6H2,1-2H3;3-7H,1-2H3;2*3-6H,1-2H3.
What are the key properties of cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline?
cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline has a molecular weight of 2920.44 g/mol, XLogP of 48.61, 21 rotatable bonds, 0 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for cumene;1-methyl-4-propan-2-ylpiperazine;1-propan-2-ylbenzimidazole;1-propan-2-yl-3,4-dihydro-2H-1,8-naphthyridine;1-propan-2-ylimidazole;bis(7-propan-2-yl-1H-indene);1-propan-2-ylindole;4-propan-2-yl-3H-indole;4-propan-2-ylmorpholine;1-propan-2-ylnaphthalene;1-propan-2-ylpiperidine;1-propan-2-ylpyrazole;2-propan-2-ylpyridine;3-propan-2-ylpyridine;4-propan-2-ylpyridine;5-propan-2-ylpyrimidine;1-propan-2-ylpyrrole;1-propan-2-ylpyrrolidine;1-propan-2-ylpyrrolo[2,3-b]pyridine;5-propan-2-ylquinoline is sourced from PubChem (CID 157152840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).