6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one

C95H126BrCl2F3N24O8 — CID 161249329

IUPAC6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESC=Cc1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(CC)n1c(=O)[nH]c2nc(C)c(C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(Br)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C(F)(F)F)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)cc21.CCC(CC)n1c(=O)[nH]c2ncccc21.CCC(CC)n1c(OC)nc2ncc(Cl)cc21
InChIInChI=1S/C13H19N3O.C13H17N3O.C12H16ClN3O.C12H14F3N3O.C12H17N3O.C11H14BrN3O.C11H14ClN3O.C11H15N3O/c1-5-10(6-2)16-11-7-8(3)9(4)14-12(11)15-13(16)17;1-4-9-7-11-12(14-8-9)15-13(17)16(11)10(5-2)6-3;1-4-9(5-2)16-10-6-8(13)7-14-11(10)15-12(16)17-3;1-3-8(4-2)18-9-5-7(12(13,14)15)6-16-10(9)17-11(18)19;1-4-9(5-2)15-10-6-8(3)7-13-11(10)14-12(15)16;2*1-3-8(4-2)15-9-5-7(12)6-13-10(9)14-11(15)16;1-3-8(4-2)14-9-6-5-7-12-10(9)13-11(14)15/h7,10H,5-6H2,1-4H3,(H,14,15,17);4,7-8,10H,1,5-6H2,2-3H3,(H,14,15,17);6-7,9H,4-5H2,1-3H3;5-6,8H,3-4H2,1-2H3,(H,16,17,19);6-7,9H,4-5H2,1-3H3,(H,13,14,16);2*5-6,8H,3-4H2,1-2H3,(H,13,14,16);5-8H,3-4H2,1-2H3,(H,12,13,15)
InChIKeyVBBFJJHTKOZJPI-UHFFFAOYSA-N
MW1940.02 g/mol
LogP22.06
Rot. Bonds26

About 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one

6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one (PubChem CID 161249329) has the molecular formula C95H126BrCl2F3N24O8 and a molecular weight of 1940.02 g/mol. Its IUPAC name is 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one
PubChem CID161249329
Molecular FormulaC95H126BrCl2F3N24O8
Molecular Weight1940.02 g/mol
Exact Mass1936.87
IUPAC Name6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one
SMILESC=Cc1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(CC)n1c(=O)[nH]c2nc(C)c(C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(Br)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C(F)(F)F)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)cc21.CCC(CC)n1c(=O)[nH]c2ncccc21.CCC(CC)n1c(OC)nc2ncc(Cl)cc21
InChIInChI=1S/C13H19N3O.C13H17N3O.C12H16ClN3O.C12H14F3N3O.C12H17N3O.C11H14BrN3O.C11H14ClN3O.C11H15N3O/c1-5-10(6-2)16-11-7-8(3)9(4)14-12(11)15-13(16)17;1-4-9-7-11-12(14-8-9)15-13(17)16(11)10(5-2)6-3;1-4-9(5-2)16-10-6-8(13)7-14-11(10)15-12(16)17-3;1-3-8(4-2)18-9-5-7(12(13,14)15)6-16-10(9)17-11(18)19;1-4-9(5-2)15-10-6-8(3)7-13-11(10)14-12(15)16;2*1-3-8(4-2)15-9-5-7(12)6-13-10(9)14-11(15)16;1-3-8(4-2)14-9-6-5-7-12-10(9)13-11(14)15/h7,10H,5-6H2,1-4H3,(H,14,15,17);4,7-8,10H,1,5-6H2,2-3H3,(H,14,15,17);6-7,9H,4-5H2,1-3H3;5-6,8H,3-4H2,1-2H3,(H,16,17,19);6-7,9H,4-5H2,1-3H3,(H,13,14,16);2*5-6,8H,3-4H2,1-2H3,(H,13,14,16);5-8H,3-4H2,1-2H3,(H,12,13,15)
InChIKeyVBBFJJHTKOZJPI-UHFFFAOYSA-N
XLogP22.06
TPSA394.70 Ų
H-Bond Donors7
H-Bond Acceptors25
Rotatable Bonds26
Heavy Atoms133
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001940.02
LogP ≤ 522.06
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1025

Analyze 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one 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

6-chloro-1-[(3R)-1-hydroxypentan-3-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 25093871
6-chloro-1-[(2R)-1-(2-hydroxyethylamino)butan-2-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 59594610
6-chloro-1-[(2R)-1-morpholin-4-ylbutan-2-yl]-3H-imidazo[4,5-b]pyridin-2-one
CID 25093797
6-fluoro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one
CID 25093762
6-bromo-1-propan-2-yl-3H-imidazo[4,5-b]pyridin-2-one
CID 134228664
6-chloro-1-(1-pyridin-4-ylethyl)-3H-imidazo[4,5-b]pyridin-2-one
CID 59594593
6-bromo-1-(1-phenylethyl)-3H-imidazo[4,5-b]pyridin-2-one;hydrochloride
CID 66699942
1-[1-ethyl-6-(trifluoromethyl)imidazo[4,5-b]pyridin-2-yl]ethanamine
CID 59177157
3-[(4-methoxyphenyl)methyl]-1-[[4-(trifluoromethyl)phenyl]methyl]pyrido[3,2-d]pyrimidine-2,4-dione
CID 18569438
7-bromo-1-butyl-3-chloropyrido[2,3-b]pyrazin-2-one
CID 137463664
5-bromo-N-[(2-methoxy-4-pyridinyl)methyl]-3-methylpyridin-2-amine
CID 79718796
5-methoxy-1-(2-methyl-3-pyridinyl)-4-(prop-2-enylamino)-7-(trifluoromethyl)quinazolin-2-one
CID 170271273

Frequently Asked Questions

What is the IUPAC name of 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one (CID 161249329) is 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one is C=Cc1cnc2[nH]c(=O)n(C(CC)CC)c2c1.CCC(CC)n1c(=O)[nH]c2nc(C)c(C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(Br)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C(F)(F)F)cc21.CCC(CC)n1c(=O)[nH]c2ncc(C)cc21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)cc21.CCC(CC)n1c(=O)[nH]c2ncccc21.CCC(CC)n1c(OC)nc2ncc(Cl)cc21.
What is the InChIKey of 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is VBBFJJHTKOZJPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N3O.C13H17N3O.C12H16ClN3O.C12H14F3N3O.C12H17N3O.C11H14BrN3O.C11H14ClN3O.C11H15N3O/c1-5-10(6-2)16-11-7-8(3)9(4)14-12(11)15-13(16)17;1-4-9-7-11-12(14-8-9)15-13(17)16(11)10(5-2)6-3;1-4-9(5-2)16-10-6-8(13)7-14-11(10)15-12(16)17-3;1-3-8(4-2)18-9-5-7(12(13,14)15)6-16-10(9)17-11(18)19;1-4-9(5-2)15-10-6-8(3)7-13-11(10)14-12(15)16;2*1-3-8(4-2)15-9-5-7(12)6-13-10(9)14-11(15)16;1-3-8(4-2)14-9-6-5-7-12-10(9)13-11(14)15/h7,10H,5-6H2,1-4H3,(H,14,15,17);4,7-8,10H,1,5-6H2,2-3H3,(H,14,15,17);6-7,9H,4-5H2,1-3H3;5-6,8H,3-4H2,1-2H3,(H,16,17,19);6-7,9H,4-5H2,1-3H3,(H,13,14,16);2*5-6,8H,3-4H2,1-2H3,(H,13,14,16);5-8H,3-4H2,1-2H3,(H,12,13,15).
What are the key properties of 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one?
6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 1940.02 g/mol, XLogP of 22.06, 26 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-2-methoxy-1-pentan-3-ylimidazo[4,5-b]pyridine;6-chloro-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;5,6-dimethyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-ethenyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-methyl-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-6-(trifluoromethyl)-3H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 161249329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).