4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate

C70H64Br2F6IN11O13 — CID 167682775

IUPAC4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate
SMILESBrc1ccn2c(I)cnc2c1.CCOC(=O)C(C)(C)Oc1ccn2c(-c3cc(OC)c(C(=O)NC4CC4)c(OC(F)F)c3)cnc2c1.COc1cc(-c2c[nH]c3cc(=O)ccn23)cc(OC(F)F)c1C(=O)NC1CC1.COc1cc(-c2cnc3cc(Br)ccn23)cc(OC(F)F)c1C(=O)NC1CC1
InChIInChI=1S/C25H27F2N3O6.C19H16BrF2N3O3.C19H17F2N3O4.C7H4BrIN2/c1-5-34-23(32)25(2,3)36-16-8-9-30-17(13-28-20(30)12-16)14-10-18(33-4)21(19(11-14)35-24(26)27)22(31)29-15-6-7-15;1-27-14-6-10(13-9-23-16-8-11(20)4-5-25(13)16)7-15(28-19(21)22)17(14)18(26)24-12-2-3-12;1-27-14-6-10(13-9-22-16-8-12(25)4-5-24(13)16)7-15(28-19(20)21)17(14)18(26)23-11-2-3-11;8-5-1-2-11-6(9)4-10-7(11)3-5/h8-13,15,24H,5-7H2,1-4H3,(H,29,31);4-9,12,19H,2-3H2,1H3,(H,24,26);4-9,11,19,22H,2-3H2,1H3,(H,23,26);1-4H
InChIKeyOSYFRPSRMYMJEQ-UHFFFAOYSA-N
MW1668.05 g/mol
LogP13.99
Rot. Bonds22

About 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate

4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate (PubChem CID 167682775) has the molecular formula C70H64Br2F6IN11O13 and a molecular weight of 1668.05 g/mol. Its IUPAC name is 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate.

Molecular Properties

Compound Name4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate
PubChem CID167682775
Molecular FormulaC70H64Br2F6IN11O13
Molecular Weight1668.05 g/mol
Exact Mass1665.20
IUPAC Name4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate
SMILESBrc1ccn2c(I)cnc2c1.CCOC(=O)C(C)(C)Oc1ccn2c(-c3cc(OC)c(C(=O)NC4CC4)c(OC(F)F)c3)cnc2c1.COc1cc(-c2c[nH]c3cc(=O)ccn23)cc(OC(F)F)c1C(=O)NC1CC1.COc1cc(-c2cnc3cc(Br)ccn23)cc(OC(F)F)c1C(=O)NC1CC1
InChIInChI=1S/C25H27F2N3O6.C19H16BrF2N3O3.C19H17F2N3O4.C7H4BrIN2/c1-5-34-23(32)25(2,3)36-16-8-9-30-17(13-28-20(30)12-16)14-10-18(33-4)21(19(11-14)35-24(26)27)22(31)29-15-6-7-15;1-27-14-6-10(13-9-23-16-8-11(20)4-5-25(13)16)7-15(28-19(21)22)17(14)18(26)24-12-2-3-12;1-27-14-6-10(13-9-22-16-8-12(25)4-5-24(13)16)7-15(28-19(20)21)17(14)18(26)23-11-2-3-11;8-5-1-2-11-6(9)4-10-7(11)3-5/h8-13,15,24H,5-7H2,1-4H3,(H,29,31);4-9,12,19H,2-3H2,1H3,(H,24,26);4-9,11,19,22H,2-3H2,1H3,(H,23,26);1-4H
InChIKeyOSYFRPSRMYMJEQ-UHFFFAOYSA-N
XLogP13.99
TPSA267.38 Ų
H-Bond Donors4
H-Bond Acceptors20
Rotatable Bonds22
Heavy Atoms103
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001668.05
LogP ≤ 513.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate?
The IUPAC name of 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate (CID 167682775) is 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate.
What is the SMILES notation for 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate?
The canonical SMILES for 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate is Brc1ccn2c(I)cnc2c1.CCOC(=O)C(C)(C)Oc1ccn2c(-c3cc(OC)c(C(=O)NC4CC4)c(OC(F)F)c3)cnc2c1.COc1cc(-c2c[nH]c3cc(=O)ccn23)cc(OC(F)F)c1C(=O)NC1CC1.COc1cc(-c2cnc3cc(Br)ccn23)cc(OC(F)F)c1C(=O)NC1CC1.
What is the InChIKey of 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate?
The InChIKey is OSYFRPSRMYMJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H27F2N3O6.C19H16BrF2N3O3.C19H17F2N3O4.C7H4BrIN2/c1-5-34-23(32)25(2,3)36-16-8-9-30-17(13-28-20(30)12-16)14-10-18(33-4)21(19(11-14)35-24(26)27)22(31)29-15-6-7-15;1-27-14-6-10(13-9-23-16-8-11(20)4-5-25(13)16)7-15(28-19(21)22)17(14)18(26)24-12-2-3-12;1-27-14-6-10(13-9-22-16-8-12(25)4-5-24(13)16)7-15(28-19(20)21)17(14)18(26)23-11-2-3-11;8-5-1-2-11-6(9)4-10-7(11)3-5/h8-13,15,24H,5-7H2,1-4H3,(H,29,31);4-9,12,19H,2-3H2,1H3,(H,24,26);4-9,11,19,22H,2-3H2,1H3,(H,23,26);1-4H.
What are the key properties of 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate?
4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate has a molecular weight of 1668.05 g/mol, XLogP of 13.99, 22 rotatable bonds, 4 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-bromoimidazo[1,2-a]pyridin-3-yl)-N-cyclopropyl-2-(difluoromethoxy)-6-methoxybenzamide;7-bromo-3-iodoimidazo[1,2-a]pyridine;N-cyclopropyl-2-(difluoromethoxy)-6-methoxy-4-(7-oxo-1H-imidazo[1,2-a]pyridin-3-yl)benzamide;ethyl 2-[3-[4-(cyclopropylcarbamoyl)-3-(difluoromethoxy)-5-methoxyphenyl]imidazo[1,2-a]pyridin-7-yl]oxy-2-methylpropanoate is sourced from PubChem (CID 167682775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).