6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine

C175H224Cl3N23 — CID 158009438

IUPAC6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine
SMILESCC(C)(C)c1cc(Cl)c2cnccc2c1.CC(C)(C)c1ccc2c(N)nccc2c1.CC(C)(C)c1ccc2cnccc2c1.CC(C)(C)c1ccc2nc(N)[nH]c2c1.CC(C)(C)c1cnc2c(c1)C(Cl)=CC2.CC(C)(C)c1cnc2c(c1)C=CC2.CC1=CCc2ncc(C(C)(C)C)cc21.Cc1cc(C(C)(C)C)cc2ccnc(N)c12.Cc1cc(C(C)(C)C)cc2ccncc12.Cc1cn(C)c2ncc(C(C)(C)C)cc12.Cc1cn(C)c2ncc(C(C)(C)C)cc12.Cc1nc(N)ccc1C(C)(C)C.Cn1cc(Cl)c2cc(C(C)(C)C)cnc21.Cn1ccc2cc(C(C)(C)C)cnc21
InChIInChI=1S/C14H18N2.C14H17N.C13H14ClN.2C13H18N2.C13H16N2.C13H17N.C13H15N.C12H15ClN2.C12H14ClN.C12H16N2.C12H15N.C11H15N3.C10H16N2/c1-9-7-11(14(2,3)4)8-10-5-6-16-13(15)12(9)10;1-10-7-12(14(2,3)4)8-11-5-6-15-9-13(10)11;1-13(2,3)10-6-9-4-5-15-8-11(9)12(14)7-10;2*1-9-8-15(5)12-11(9)6-10(7-14-12)13(2,3)4;1-13(2,3)10-4-5-11-9(8-10)6-7-15-12(11)14;1-9-5-6-12-11(9)7-10(8-14-12)13(2,3)4;1-13(2,3)12-5-4-11-9-14-7-6-10(11)8-12;1-12(2,3)8-5-9-10(13)7-15(4)11(9)14-6-8;1-12(2,3)8-6-9-10(13)4-5-11(9)14-7-8;1-12(2,3)10-7-9-5-6-14(4)11(9)13-8-10;1-12(2,3)10-7-9-5-4-6-11(9)13-8-10;1-11(2,3)7-4-5-8-9(6-7)14-10(12)13-8;1-7-8(10(2,3)4)5-6-9(11)12-7/h5-8H,1-4H3,(H2,15,16);5-9H,1-4H3;4-8H,1-3H3;2*6-8H,1-5H3;4-8H,1-3H3,(H2,14,15);5,7-8H,6H2,1-4H3;4-9H,1-3H3;5-7H,1-4H3;4,6-7H,5H2,1-3H3;5-8H,1-4H3;4-5,7-8H,6H2,1-3H3;4-6H,1-3H3,(H3,12,13,14);5-6H,1-4H3,(H2,11,12)
InChIKeyFERWRCUWXGTYLF-UHFFFAOYSA-N
MW2756.24 g/mol
LogP45.36
Rot. Bonds

About 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine

6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine (PubChem CID 158009438) has the molecular formula C175H224Cl3N23 and a molecular weight of 2756.24 g/mol. Its IUPAC name is 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine.

Molecular Properties

Compound Name6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine
PubChem CID158009438
Molecular FormulaC175H224Cl3N23
Molecular Weight2756.24 g/mol
Exact Mass2752.73
IUPAC Name6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine
SMILESCC(C)(C)c1cc(Cl)c2cnccc2c1.CC(C)(C)c1ccc2c(N)nccc2c1.CC(C)(C)c1ccc2cnccc2c1.CC(C)(C)c1ccc2nc(N)[nH]c2c1.CC(C)(C)c1cnc2c(c1)C(Cl)=CC2.CC(C)(C)c1cnc2c(c1)C=CC2.CC1=CCc2ncc(C(C)(C)C)cc21.Cc1cc(C(C)(C)C)cc2ccnc(N)c12.Cc1cc(C(C)(C)C)cc2ccncc12.Cc1cn(C)c2ncc(C(C)(C)C)cc12.Cc1cn(C)c2ncc(C(C)(C)C)cc12.Cc1nc(N)ccc1C(C)(C)C.Cn1cc(Cl)c2cc(C(C)(C)C)cnc21.Cn1ccc2cc(C(C)(C)C)cnc21
InChIInChI=1S/C14H18N2.C14H17N.C13H14ClN.2C13H18N2.C13H16N2.C13H17N.C13H15N.C12H15ClN2.C12H14ClN.C12H16N2.C12H15N.C11H15N3.C10H16N2/c1-9-7-11(14(2,3)4)8-10-5-6-16-13(15)12(9)10;1-10-7-12(14(2,3)4)8-11-5-6-15-9-13(10)11;1-13(2,3)10-6-9-4-5-15-8-11(9)12(14)7-10;2*1-9-8-15(5)12-11(9)6-10(7-14-12)13(2,3)4;1-13(2,3)10-4-5-11-9(8-10)6-7-15-12(11)14;1-9-5-6-12-11(9)7-10(8-14-12)13(2,3)4;1-13(2,3)12-5-4-11-9-14-7-6-10(11)8-12;1-12(2,3)8-5-9-10(13)7-15(4)11(9)14-6-8;1-12(2,3)8-6-9-10(13)4-5-11(9)14-7-8;1-12(2,3)10-7-9-5-6-14(4)11(9)13-8-10;1-12(2,3)10-7-9-5-4-6-11(9)13-8-10;1-11(2,3)7-4-5-8-9(6-7)14-10(12)13-8;1-7-8(10(2,3)4)5-6-9(11)12-7/h5-8H,1-4H3,(H2,15,16);5-9H,1-4H3;4-8H,1-3H3;2*6-8H,1-5H3;4-8H,1-3H3,(H2,14,15);5,7-8H,6H2,1-4H3;4-9H,1-3H3;5-7H,1-4H3;4,6-7H,5H2,1-3H3;5-8H,1-4H3;4-5,7-8H,6H2,1-3H3;4-6H,1-3H3,(H3,12,13,14);5-6H,1-4H3,(H2,11,12)
InChIKeyFERWRCUWXGTYLF-UHFFFAOYSA-N
XLogP45.36
TPSA320.05 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds
Heavy Atoms201
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002756.24
LogP ≤ 545.36
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Analyze 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine with MolForge

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Launch Full Analysis

Related Compounds

CID 157083796
CID 157083796
3-[(5,8-dichloronaphthalen-2-yl)methyl]-2H-pyrazolo[4,3-b]pyridine;1-(3,3-difluorobutan-2-yl)-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(difluoromethyl)naphthalen-2-yl]-1H-pyrazolo[4,3-b]pyridin-3-amine;1-ethyl-3-methyl-N-(1H-pyrazolo[4,3-b]pyridin-3-yl)isoquinolin-6-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyrazin-3-amine;N-[5-(trifluoromethyl)naphthalen-2-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine
CID 157274566
1-[4,6-Bis(5-chloro-2-methylbenzimidazol-1-yl)-1,3,5-triazin-2-yl]-5-chloro-2-methylbenzimidazole;1-[4,6-bis(2,5-dimethylbenzimidazol-1-yl)-1,3,5-triazin-2-yl]-2,5-dimethylbenzimidazole;9-[4,6-bis(1-methylcarbazol-9-yl)-1,3,5-triazin-2-yl]-1-methylcarbazole;bis(3-[4,6-bis(2-methylimidazo[4,5-b]pyridin-3-yl)-1,3,5-triazin-2-yl]-2-methylimidazo[4,5-b]pyridine);1-[4,6-bis[2-(trifluoromethyl)benzimidazol-1-yl]-1,3,5-triazin-2-yl]-2-(trifluoromethyl)benzimidazole;9-[4,6-di(carbazol-9-yl)-1,3,5-triazin-2-yl]carbazole;2-methyl-1-[2-[2-(2-methylbenzimidazol-1-yl)phenyl]phenyl]benzimidazole
CID 157458102
CID 157458247
CID 157458247
CID 157544448
CID 157544448
N-[(1S)-1-[8-chloro-1-[2-(3,3-difluoroazetidin-1-yl)ethyl]isoquinolin-3-yl]ethyl]-7H-purin-6-amine;N-[(1S)-1-[8-chloro-1-[2-(3,3-difluoropyrrolidin-1-yl)ethyl]isoquinolin-3-yl]ethyl]-7H-purin-6-amine;N-[(1S)-1-[8-chloro-1-(2-pyrrolidin-1-ylethyl)isoquinolin-3-yl]ethyl]-7H-purin-6-amine
CID 157594836
CID 157595394
CID 157595394
1-chloro-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole;1,9-dimethyl-4-[(2S)-1-methylpyrrolidin-2-yl]pyrido[3,4-b]indole;1-methyl-4-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[3,4-b]indole;9-methyl-3-[(2S)-1-methylpyrrolidin-2-yl]pyrido[2,3-b]indole;3-[(2S)-1-methylpyrrolidin-2-yl]-9H-pyrido[2,3-b]indole;3-[(2S)-1-methylpyrrolidin-2-yl]-4-(trifluoromethyl)-9H-pyrido[2,3-b]indole
CID 157781785
8-chloro-7-[(1R)-1-(5-methyl-1H-imidazol-4-yl)ethyl]-3-(trifluoromethyl)quinoline;N,N-dimethyl-6-[(1S)-1-(5-methyl-1H-imidazol-4-yl)ethyl]-8-propan-2-ylquinolin-3-amine;5-[(5-methyl-1H-imidazol-4-yl)methyl]-1H-quinoline-4-thione;N-methyl-1-[4-[1-(5-methyl-1H-imidazol-4-yl)ethyl]quinolin-6-yl]methanamine;1-methyl-5-[(5-methyl-1H-imidazol-4-yl)methyl]isoquinoline;N-methyl-1-[3-[2,2,2-trifluoro-1-(5-methyl-1H-imidazol-4-yl)ethyl]quinolin-5-yl]methanamine
CID 158212982
CID 158475468
CID 158475468
N-[(1S)-1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenylethyl]-1H-benzimidazol-2-amine;N-[1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenylethyl]-6-(1,1-difluoroethyl)-1H-benzimidazol-2-amine;N-[1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenylethyl]-5-fluoro-4-methyl-1H-benzimidazol-2-amine;bis(N-[1-(5-chloro-2-pyridinyl)-1-[3-fluoro-5-(trifluoromethyl)phenyl]-2-phenylethyl]-6-methyl-1H-benzimidazol-2-amine)
CID 158583131
2-[3,5-Bis[1-(4-tert-butylphenyl)benzimidazol-2-yl]phenyl]-1-(4-tert-butylphenyl)benzimidazole;2-[3,5-bis[3-(3-phenylphenyl)imidazo[4,5-b]pyridin-2-yl]phenyl]-3-(3-phenylphenyl)imidazo[4,5-b]pyridine;8-[2-[3,5-bis(3-quinolin-8-ylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridin-3-yl]quinoline;1-(3-methylphenyl)-2-[3-[1-(3-methylphenyl)benzimidazol-2-yl]-5-[1-[3-(trifluoromethyl)phenyl]benzimidazol-2-yl]phenyl]benzimidazole;1-phenyl-2-[4-(1-phenylimidazo[4,5-b]pyridin-2-yl)phenyl]imidazo[4,5-b]pyridine
CID 158818180

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine?
The IUPAC name of 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine (CID 158009438) is 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine.
What is the SMILES notation for 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine?
The canonical SMILES for 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine is CC(C)(C)c1cc(Cl)c2cnccc2c1.CC(C)(C)c1ccc2c(N)nccc2c1.CC(C)(C)c1ccc2cnccc2c1.CC(C)(C)c1ccc2nc(N)[nH]c2c1.CC(C)(C)c1cnc2c(c1)C(Cl)=CC2.CC(C)(C)c1cnc2c(c1)C=CC2.CC1=CCc2ncc(C(C)(C)C)cc21.Cc1cc(C(C)(C)C)cc2ccnc(N)c12.Cc1cc(C(C)(C)C)cc2ccncc12.Cc1cn(C)c2ncc(C(C)(C)C)cc12.Cc1cn(C)c2ncc(C(C)(C)C)cc12.Cc1nc(N)ccc1C(C)(C)C.Cn1cc(Cl)c2cc(C(C)(C)C)cnc21.Cn1ccc2cc(C(C)(C)C)cnc21.
What is the InChIKey of 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine?
The InChIKey is FERWRCUWXGTYLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2.C14H17N.C13H14ClN.2C13H18N2.C13H16N2.C13H17N.C13H15N.C12H15ClN2.C12H14ClN.C12H16N2.C12H15N.C11H15N3.C10H16N2/c1-9-7-11(14(2,3)4)8-10-5-6-16-13(15)12(9)10;1-10-7-12(14(2,3)4)8-11-5-6-15-9-13(10)11;1-13(2,3)10-6-9-4-5-15-8-11(9)12(14)7-10;2*1-9-8-15(5)12-11(9)6-10(7-14-12)13(2,3)4;1-13(2,3)10-4-5-11-9(8-10)6-7-15-12(11)14;1-9-5-6-12-11(9)7-10(8-14-12)13(2,3)4;1-13(2,3)12-5-4-11-9-14-7-6-10(11)8-12;1-12(2,3)8-5-9-10(13)7-15(4)11(9)14-6-8;1-12(2,3)8-6-9-10(13)4-5-11(9)14-7-8;1-12(2,3)10-7-9-5-6-14(4)11(9)13-8-10;1-12(2,3)10-7-9-5-4-6-11(9)13-8-10;1-11(2,3)7-4-5-8-9(6-7)14-10(12)13-8;1-7-8(10(2,3)4)5-6-9(11)12-7/h5-8H,1-4H3,(H2,15,16);5-9H,1-4H3;4-8H,1-3H3;2*6-8H,1-5H3;4-8H,1-3H3,(H2,14,15);5,7-8H,6H2,1-4H3;4-9H,1-3H3;5-7H,1-4H3;4,6-7H,5H2,1-3H3;5-8H,1-4H3;4-5,7-8H,6H2,1-3H3;4-6H,1-3H3,(H3,12,13,14);5-6H,1-4H3,(H2,11,12).
What are the key properties of 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine?
6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine has a molecular weight of 2756.24 g/mol, XLogP of 45.36, 0 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-1H-benzimidazol-2-amine;3-tert-butyl-5-chloro-7H-cyclopenta[b]pyridine;6-tert-butyl-8-chloroisoquinoline;5-tert-butyl-3-chloro-1-methylpyrrolo[2,3-b]pyridine;3-tert-butyl-7H-cyclopenta[b]pyridine;bis(5-tert-butyl-1,3-dimethylpyrrolo[2,3-b]pyridine);6-tert-butylisoquinolin-1-amine;6-tert-butylisoquinoline;3-tert-butyl-5-methyl-7H-cyclopenta[b]pyridine;6-tert-butyl-8-methylisoquinolin-1-amine;6-tert-butyl-8-methylisoquinoline;5-tert-butyl-6-methylpyridin-2-amine;5-tert-butyl-1-methylpyrrolo[2,3-b]pyridine is sourced from PubChem (CID 158009438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).