6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one

C84H86Cl5FN18O5 — CID 158300484

IUPAC6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one
SMILESCCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3ccc(C#N)cc3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cccc(Cl)c3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cccc(F)c3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cncnc3)c21.CCC(CC)n1c(=O)[nH]c2nccc(-c3ccccc3)c21
InChIInChI=1S/C18H17ClN4O.C17H17Cl2N3O.C17H17ClFN3O.C17H19N3O.C15H16ClN5O/c1-3-13(4-2)23-16-15(12-7-5-11(9-20)6-8-12)14(19)10-21-17(16)22-18(23)24;1-3-12(4-2)22-15-14(10-6-5-7-11(18)8-10)13(19)9-20-16(15)21-17(22)23;1-3-12(4-2)22-15-14(10-6-5-7-11(19)8-10)13(18)9-20-16(15)21-17(22)23;1-3-13(4-2)20-15-14(12-8-6-5-7-9-12)10-11-18-16(15)19-17(20)21;1-3-10(4-2)21-13-12(9-5-17-8-18-6-9)11(16)7-19-14(13)20-15(21)22/h5-8,10,13H,3-4H2,1-2H3,(H,21,22,24);2*5-9,12H,3-4H2,1-2H3,(H,20,21,23);5-11,13H,3-4H2,1-2H3,(H,18,19,21);5-8,10H,3-4H2,1-2H3,(H,19,20,22)
InChIKeyGMLCSGVPJJZXGO-UHFFFAOYSA-N
MW1624.00 g/mol
LogP20.83
Rot. Bonds20

About 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one

6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one (PubChem CID 158300484) has the molecular formula C84H86Cl5FN18O5 and a molecular weight of 1624.00 g/mol. Its IUPAC name is 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one.

Molecular Properties

Compound Name6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one
PubChem CID158300484
Molecular FormulaC84H86Cl5FN18O5
Molecular Weight1624.00 g/mol
Exact Mass1620.55
IUPAC Name6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one
SMILESCCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3ccc(C#N)cc3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cccc(Cl)c3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cccc(F)c3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cncnc3)c21.CCC(CC)n1c(=O)[nH]c2nccc(-c3ccccc3)c21
InChIInChI=1S/C18H17ClN4O.C17H17Cl2N3O.C17H17ClFN3O.C17H19N3O.C15H16ClN5O/c1-3-13(4-2)23-16-15(12-7-5-11(9-20)6-8-12)14(19)10-21-17(16)22-18(23)24;1-3-12(4-2)22-15-14(10-6-5-7-11(18)8-10)13(19)9-20-16(15)21-17(22)23;1-3-12(4-2)22-15-14(10-6-5-7-11(19)8-10)13(18)9-20-16(15)21-17(22)23;1-3-13(4-2)20-15-14(12-8-6-5-7-9-12)10-11-18-16(15)19-17(20)21;1-3-10(4-2)21-13-12(9-5-17-8-18-6-9)11(16)7-19-14(13)20-15(21)22/h5-8,10,13H,3-4H2,1-2H3,(H,21,22,24);2*5-9,12H,3-4H2,1-2H3,(H,20,21,23);5-11,13H,3-4H2,1-2H3,(H,18,19,21);5-8,10H,3-4H2,1-2H3,(H,19,20,22)
InChIKeyGMLCSGVPJJZXGO-UHFFFAOYSA-N
XLogP20.83
TPSA302.97 Ų
H-Bond Donors5
H-Bond Acceptors18
Rotatable Bonds20
Heavy Atoms113
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001624.00
LogP ≤ 520.83
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1018

Analyze 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one?
The IUPAC name of 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one (CID 158300484) is 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one.
What is the SMILES notation for 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one?
The canonical SMILES for 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one is CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3ccc(C#N)cc3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cccc(Cl)c3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cccc(F)c3)c21.CCC(CC)n1c(=O)[nH]c2ncc(Cl)c(-c3cncnc3)c21.CCC(CC)n1c(=O)[nH]c2nccc(-c3ccccc3)c21.
What is the InChIKey of 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one?
The InChIKey is GMLCSGVPJJZXGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17ClN4O.C17H17Cl2N3O.C17H17ClFN3O.C17H19N3O.C15H16ClN5O/c1-3-13(4-2)23-16-15(12-7-5-11(9-20)6-8-12)14(19)10-21-17(16)22-18(23)24;1-3-12(4-2)22-15-14(10-6-5-7-11(18)8-10)13(19)9-20-16(15)21-17(22)23;1-3-12(4-2)22-15-14(10-6-5-7-11(19)8-10)13(18)9-20-16(15)21-17(22)23;1-3-13(4-2)20-15-14(12-8-6-5-7-9-12)10-11-18-16(15)19-17(20)21;1-3-10(4-2)21-13-12(9-5-17-8-18-6-9)11(16)7-19-14(13)20-15(21)22/h5-8,10,13H,3-4H2,1-2H3,(H,21,22,24);2*5-9,12H,3-4H2,1-2H3,(H,20,21,23);5-11,13H,3-4H2,1-2H3,(H,18,19,21);5-8,10H,3-4H2,1-2H3,(H,19,20,22).
What are the key properties of 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one?
6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one has a molecular weight of 1624.00 g/mol, XLogP of 20.83, 20 rotatable bonds, 5 hydrogen bond donors, and 18 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-7-(3-chlorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;6-chloro-7-(3-fluorophenyl)-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-2-one;4-(6-chloro-2-oxo-1-pentan-3-yl-3H-imidazo[4,5-b]pyridin-7-yl)benzonitrile;6-chloro-1-pentan-3-yl-7-pyrimidin-5-yl-3H-imidazo[4,5-b]pyridin-2-one;1-pentan-3-yl-7-phenyl-3H-imidazo[4,5-b]pyridin-2-one is sourced from PubChem (CID 158300484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).