6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one

C82H78F3N27O4S — CID 163495095

IUPAC6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one
SMILESCC(F)Cn1ccc(-c2nc3n(c2-c2ccc4nc[nH]c(=O)c4c2)CCC3)n1.CC(F)Cn1ccc(-c2nc3n(c2-c2ccc4ncc(C(N)=O)n4c2)CCC3)n1.CC1(F)CC(n2ccc(-c3nc4n(c3-c3ccc5ncc(C(N)=O)n5c3)CCC4)n2)C1.NC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CCC5)n4)nc4sccn34)cn12
InChIInChI=1S/C22H22FN7O.C20H20FN7O.C20H19FN6O.C20H17N7OS/c1-22(23)9-14(10-22)30-8-6-15(27-30)19-20(28-7-2-3-18(28)26-19)13-4-5-17-25-11-16(21(24)31)29(17)12-13;1-12(21)10-26-8-6-14(25-26)18-19(27-7-2-3-17(27)24-18)13-4-5-16-23-9-15(20(22)29)28(16)11-13;1-12(21)10-26-8-6-16(25-26)18-19(27-7-2-3-17(27)24-18)13-4-5-15-14(9-13)20(28)23-11-22-15;21-19(28)15-10-22-16-5-4-12(11-26(15)16)18-17(23-20-25(18)8-9-29-20)14-6-7-27(24-14)13-2-1-3-13/h4-6,8,11-12,14H,2-3,7,9-10H2,1H3,(H2,24,31);4-6,8-9,11-12H,2-3,7,10H2,1H3,(H2,22,29);4-6,8-9,11-12H,2-3,7,10H2,1H3,(H,22,23,28);4-11,13H,1-3H2,(H2,21,28)
InChIKeyCQABDWVVAKRBHQ-UHFFFAOYSA-N
MW1594.77 g/mol
LogP11.99
Rot. Bonds17

About 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one

6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one (PubChem CID 163495095) has the molecular formula C82H78F3N27O4S and a molecular weight of 1594.77 g/mol. Its IUPAC name is 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one.

Molecular Properties

Compound Name6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one
PubChem CID163495095
Molecular FormulaC82H78F3N27O4S
Molecular Weight1594.77 g/mol
Exact Mass1593.64
IUPAC Name6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one
SMILESCC(F)Cn1ccc(-c2nc3n(c2-c2ccc4nc[nH]c(=O)c4c2)CCC3)n1.CC(F)Cn1ccc(-c2nc3n(c2-c2ccc4ncc(C(N)=O)n4c2)CCC3)n1.CC1(F)CC(n2ccc(-c3nc4n(c3-c3ccc5ncc(C(N)=O)n5c3)CCC4)n2)C1.NC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CCC5)n4)nc4sccn34)cn12
InChIInChI=1S/C22H22FN7O.C20H20FN7O.C20H19FN6O.C20H17N7OS/c1-22(23)9-14(10-22)30-8-6-15(27-30)19-20(28-7-2-3-18(28)26-19)13-4-5-17-25-11-16(21(24)31)29(17)12-13;1-12(21)10-26-8-6-14(25-26)18-19(27-7-2-3-17(27)24-18)13-4-5-16-23-9-15(20(22)29)28(16)11-13;1-12(21)10-26-8-6-16(25-26)18-19(27-7-2-3-17(27)24-18)13-4-5-15-14(9-13)20(28)23-11-22-15;21-19(28)15-10-22-16-5-4-12(11-26(15)16)18-17(23-20-25(18)8-9-29-20)14-6-7-27(24-14)13-2-1-3-13/h4-6,8,11-12,14H,2-3,7,9-10H2,1H3,(H2,24,31);4-6,8-9,11-12H,2-3,7,10H2,1H3,(H2,22,29);4-6,8-9,11-12H,2-3,7,10H2,1H3,(H,22,23,28);4-11,13H,1-3H2,(H2,21,28)
InChIKeyCQABDWVVAKRBHQ-UHFFFAOYSA-N
XLogP11.99
TPSA368.96 Ų
H-Bond Donors4
H-Bond Acceptors28
Rotatable Bonds17
Heavy Atoms117
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001594.77
LogP ≤ 511.99
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1028

Analyze 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one?
The IUPAC name of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one (CID 163495095) is 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one.
What is the SMILES notation for 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one?
The canonical SMILES for 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one is CC(F)Cn1ccc(-c2nc3n(c2-c2ccc4nc[nH]c(=O)c4c2)CCC3)n1.CC(F)Cn1ccc(-c2nc3n(c2-c2ccc4ncc(C(N)=O)n4c2)CCC3)n1.CC1(F)CC(n2ccc(-c3nc4n(c3-c3ccc5ncc(C(N)=O)n5c3)CCC4)n2)C1.NC(=O)c1cnc2ccc(-c3c(-c4ccn(C5CCC5)n4)nc4sccn34)cn12.
What is the InChIKey of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one?
The InChIKey is CQABDWVVAKRBHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22FN7O.C20H20FN7O.C20H19FN6O.C20H17N7OS/c1-22(23)9-14(10-22)30-8-6-15(27-30)19-20(28-7-2-3-18(28)26-19)13-4-5-17-25-11-16(21(24)31)29(17)12-13;1-12(21)10-26-8-6-14(25-26)18-19(27-7-2-3-17(27)24-18)13-4-5-16-23-9-15(20(22)29)28(16)11-13;1-12(21)10-26-8-6-16(25-26)18-19(27-7-2-3-17(27)24-18)13-4-5-15-14(9-13)20(28)23-11-22-15;21-19(28)15-10-22-16-5-4-12(11-26(15)16)18-17(23-20-25(18)8-9-29-20)14-6-7-27(24-14)13-2-1-3-13/h4-6,8,11-12,14H,2-3,7,9-10H2,1H3,(H2,24,31);4-6,8-9,11-12H,2-3,7,10H2,1H3,(H2,22,29);4-6,8-9,11-12H,2-3,7,10H2,1H3,(H,22,23,28);4-11,13H,1-3H2,(H2,21,28).
What are the key properties of 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one?
6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one has a molecular weight of 1594.77 g/mol, XLogP of 11.99, 17 rotatable bonds, 4 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[6-(1-cyclobutylpyrazol-3-yl)imidazo[2,1-b][1,3]thiazol-5-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(3-fluoro-3-methylcyclobutyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]imidazo[1,2-a]pyridine-3-carboxamide;6-[2-[1-(2-fluoropropyl)pyrazol-3-yl]-6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-3-yl]-3H-quinazolin-4-one is sourced from PubChem (CID 163495095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).