1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole

C146H176F3N25O2 — CID 160723814

IUPAC1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole
SMILESCC(C)c1cc(-c2ccc3c(cnn3C)c2)ncc1C(F)F.CC(C)c1cc(-c2ccc3c(cnn3C)c2)ncc1F.CC(C)c1ccc2c(c1)CC=N2.CC(C)c1ccc2c(c1)n(C)c(=O)n2C.CC(C)c1ccc2c(c1)ncn2Cc1ccccc1.COc1cnc(-c2ccc3c(cnn3C)c2)cc1C(C)C.Cc1cnc(-c2ccc3c(cnn3C)c2)cc1C(C)C.Cc1nc2c([nH]1)CN(C(C)C)CC2.Cc1nc2cc(C(C)C)ccc2n1C1CCN(C)CC1.Cc1nc2ccc(C(C)C)cc2n1C
InChIInChI=1S/C17H17F2N3.C17H19N3O.C17H19N3.C17H25N3.C17H18N2.C16H16FN3.C12H16N2O.C12H16N2.C11H13N.C10H17N3/c1-10(2)13-7-15(20-9-14(13)17(18)19)11-4-5-16-12(6-11)8-21-22(16)3;1-11(2)14-8-15(18-10-17(14)21-4)12-5-6-16-13(7-12)9-19-20(16)3;1-11(2)15-8-16(18-9-12(15)3)13-5-6-17-14(7-13)10-19-20(17)4;1-12(2)14-5-6-17-16(11-14)18-13(3)20(17)15-7-9-19(4)10-8-15;1-13(2)15-8-9-17-16(10-15)18-12-19(17)11-14-6-4-3-5-7-14;1-10(2)13-7-15(18-9-14(13)17)11-4-5-16-12(6-11)8-19-20(16)3;1-8(2)9-5-6-10-11(7-9)14(4)12(15)13(10)3;1-8(2)10-5-6-11-12(7-10)14(4)9(3)13-11;1-8(2)9-3-4-11-10(7-9)5-6-12-11;1-7(2)13-5-4-9-10(6-13)12-8(3)11-9/h4-10,17H,1-3H3;5-11H,1-4H3;5-11H,1-4H3;5-6,11-12,15H,7-10H2,1-4H3;3-10,12-13H,11H2,1-2H3;4-10H,1-3H3;5-8H,1-4H3;5-8H,1-4H3;3-4,6-8H,5H2,1-2H3;7H,4-6H2,1-3H3,(H,11,12)
InChIKeyRTLFAOVXCJXAGB-UHFFFAOYSA-N
MW2370.18 g/mol
LogP33.93
Rot. Bonds19

About 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole

1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole (PubChem CID 160723814) has the molecular formula C146H176F3N25O2 and a molecular weight of 2370.18 g/mol. Its IUPAC name is 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole.

Molecular Properties

Compound Name1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole
PubChem CID160723814
Molecular FormulaC146H176F3N25O2
Molecular Weight2370.18 g/mol
Exact Mass2368.44
IUPAC Name1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole
SMILESCC(C)c1cc(-c2ccc3c(cnn3C)c2)ncc1C(F)F.CC(C)c1cc(-c2ccc3c(cnn3C)c2)ncc1F.CC(C)c1ccc2c(c1)CC=N2.CC(C)c1ccc2c(c1)n(C)c(=O)n2C.CC(C)c1ccc2c(c1)ncn2Cc1ccccc1.COc1cnc(-c2ccc3c(cnn3C)c2)cc1C(C)C.Cc1cnc(-c2ccc3c(cnn3C)c2)cc1C(C)C.Cc1nc2c([nH]1)CN(C(C)C)CC2.Cc1nc2cc(C(C)C)ccc2n1C1CCN(C)CC1.Cc1nc2ccc(C(C)C)cc2n1C
InChIInChI=1S/C17H17F2N3.C17H19N3O.C17H19N3.C17H25N3.C17H18N2.C16H16FN3.C12H16N2O.C12H16N2.C11H13N.C10H17N3/c1-10(2)13-7-15(20-9-14(13)17(18)19)11-4-5-16-12(6-11)8-21-22(16)3;1-11(2)14-8-15(18-10-17(14)21-4)12-5-6-16-13(7-12)9-19-20(16)3;1-11(2)15-8-16(18-9-12(15)3)13-5-6-17-14(7-13)10-19-20(17)4;1-12(2)14-5-6-17-16(11-14)18-13(3)20(17)15-7-9-19(4)10-8-15;1-13(2)15-8-9-17-16(10-15)18-12-19(17)11-14-6-4-3-5-7-14;1-10(2)13-7-15(18-9-14(13)17)11-4-5-16-12(6-11)8-19-20(16)3;1-8(2)9-5-6-10-11(7-9)14(4)12(15)13(10)3;1-8(2)10-5-6-11-12(7-10)14(4)9(3)13-11;1-8(2)9-3-4-11-10(7-9)5-6-12-11;1-7(2)13-5-4-9-10(6-13)12-8(3)11-9/h4-10,17H,1-3H3;5-11H,1-4H3;5-11H,1-4H3;5-6,11-12,15H,7-10H2,1-4H3;3-10,12-13H,11H2,1-2H3;4-10H,1-3H3;5-8H,1-4H3;5-8H,1-4H3;3-4,6-8H,5H2,1-2H3;7H,4-6H2,1-3H3,(H,11,12)
InChIKeyRTLFAOVXCJXAGB-UHFFFAOYSA-N
XLogP33.93
TPSA259.98 Ų
H-Bond Donors1
H-Bond Acceptors26
Rotatable Bonds19
Heavy Atoms176
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002370.18
LogP ≤ 533.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1026

Analyze 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole 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

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole?
The IUPAC name of 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole (CID 160723814) is 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole.
What is the SMILES notation for 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole?
The canonical SMILES for 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole is CC(C)c1cc(-c2ccc3c(cnn3C)c2)ncc1C(F)F.CC(C)c1cc(-c2ccc3c(cnn3C)c2)ncc1F.CC(C)c1ccc2c(c1)CC=N2.CC(C)c1ccc2c(c1)n(C)c(=O)n2C.CC(C)c1ccc2c(c1)ncn2Cc1ccccc1.COc1cnc(-c2ccc3c(cnn3C)c2)cc1C(C)C.Cc1cnc(-c2ccc3c(cnn3C)c2)cc1C(C)C.Cc1nc2c([nH]1)CN(C(C)C)CC2.Cc1nc2cc(C(C)C)ccc2n1C1CCN(C)CC1.Cc1nc2ccc(C(C)C)cc2n1C.
What is the InChIKey of 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole?
The InChIKey is RTLFAOVXCJXAGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17F2N3.C17H19N3O.C17H19N3.C17H25N3.C17H18N2.C16H16FN3.C12H16N2O.C12H16N2.C11H13N.C10H17N3/c1-10(2)13-7-15(20-9-14(13)17(18)19)11-4-5-16-12(6-11)8-21-22(16)3;1-11(2)14-8-15(18-10-17(14)21-4)12-5-6-16-13(7-12)9-19-20(16)3;1-11(2)15-8-16(18-9-12(15)3)13-5-6-17-14(7-13)10-19-20(17)4;1-12(2)14-5-6-17-16(11-14)18-13(3)20(17)15-7-9-19(4)10-8-15;1-13(2)15-8-9-17-16(10-15)18-12-19(17)11-14-6-4-3-5-7-14;1-10(2)13-7-15(18-9-14(13)17)11-4-5-16-12(6-11)8-19-20(16)3;1-8(2)9-5-6-10-11(7-9)14(4)12(15)13(10)3;1-8(2)10-5-6-11-12(7-10)14(4)9(3)13-11;1-8(2)9-3-4-11-10(7-9)5-6-12-11;1-7(2)13-5-4-9-10(6-13)12-8(3)11-9/h4-10,17H,1-3H3;5-11H,1-4H3;5-11H,1-4H3;5-6,11-12,15H,7-10H2,1-4H3;3-10,12-13H,11H2,1-2H3;4-10H,1-3H3;5-8H,1-4H3;5-8H,1-4H3;3-4,6-8H,5H2,1-2H3;7H,4-6H2,1-3H3,(H,11,12).
What are the key properties of 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole?
1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole has a molecular weight of 2370.18 g/mol, XLogP of 33.93, 19 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-5-propan-2-ylbenzimidazole;5-[5-(difluoromethyl)-4-propan-2-yl-2-pyridinyl]-1-methylindazole;1,2-dimethyl-6-propan-2-ylbenzimidazole;1,3-dimethyl-5-propan-2-ylbenzimidazol-2-one;5-(5-fluoro-4-propan-2-yl-2-pyridinyl)-1-methylindazole;5-(5-methoxy-4-propan-2-yl-2-pyridinyl)-1-methylindazole;2-methyl-1-(1-methylpiperidin-4-yl)-5-propan-2-ylbenzimidazole;1-methyl-5-(5-methyl-4-propan-2-yl-2-pyridinyl)indazole;2-methyl-5-propan-2-yl-3,4,6,7-tetrahydroimidazo[4,5-c]pyridine;5-propan-2-yl-3H-indole is sourced from PubChem (CID 160723814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).