N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

C98H94F5N19O12 — CID 161260673

IUPACN-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCC(F)(F)c1ccc(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)cn1.O=C(NCC1CC12CCN(C(=O)c1cc(C(F)(F)F)ccn1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1ccc(-c3ccn[nH]3)cc1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1ccc(-n3ccnc3)nc1)CC2)c1cc2ccncc2o1
InChIInChI=1S/C26H25N5O3.C25H24N6O3.C24H24F2N4O3.C23H21F3N4O3/c32-24(22-13-19-5-9-27-16-23(19)34-22)28-15-20-14-26(20)7-11-31(12-8-26)25(33)18-3-1-17(2-4-18)21-6-10-29-30-21;32-23(20-11-17-3-6-26-15-21(17)34-20)29-14-19-12-25(19)4-8-30(9-5-25)24(33)18-1-2-22(28-13-18)31-10-7-27-16-31;1-23(25,26)20-3-2-16(12-28-20)22(32)30-8-5-24(6-9-30)11-17(24)13-29-21(31)18-10-15-4-7-27-14-19(15)33-18;24-23(25,26)15-2-6-28-17(10-15)21(32)30-7-3-22(4-8-30)11-16(22)12-29-20(31)18-9-14-1-5-27-13-19(14)33-18/h1-6,9-10,13,16,20H,7-8,11-12,14-15H2,(H,28,32)(H,29,30);1-3,6-7,10-11,13,15-16,19H,4-5,8-9,12,14H2,(H,29,32);2-4,7,10,12,14,17H,5-6,8-9,11,13H2,1H3,(H,29,31);1-2,5-6,9-10,13,16H,3-4,7-8,11-12H2,(H,29,31)
InChIKeyVCMSERYMXNGHNA-UHFFFAOYSA-N
MW1824.94 g/mol
LogP14.89
Rot. Bonds19

About N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 161260673) has the molecular formula C98H94F5N19O12 and a molecular weight of 1824.94 g/mol. Its IUPAC name is N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID161260673
Molecular FormulaC98H94F5N19O12
Molecular Weight1824.94 g/mol
Exact Mass1823.72
IUPAC NameN-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESCC(F)(F)c1ccc(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)cn1.O=C(NCC1CC12CCN(C(=O)c1cc(C(F)(F)F)ccn1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1ccc(-c3ccn[nH]3)cc1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1ccc(-n3ccnc3)nc1)CC2)c1cc2ccncc2o1
InChIInChI=1S/C26H25N5O3.C25H24N6O3.C24H24F2N4O3.C23H21F3N4O3/c32-24(22-13-19-5-9-27-16-23(19)34-22)28-15-20-14-26(20)7-11-31(12-8-26)25(33)18-3-1-17(2-4-18)21-6-10-29-30-21;32-23(20-11-17-3-6-26-15-21(17)34-20)29-14-19-12-25(19)4-8-30(9-5-25)24(33)18-1-2-22(28-13-18)31-10-7-27-16-31;1-23(25,26)20-3-2-16(12-28-20)22(32)30-8-5-24(6-9-30)11-17(24)13-29-21(31)18-10-15-4-7-27-14-19(15)33-18;24-23(25,26)15-2-6-28-17(10-15)21(32)30-7-3-22(4-8-30)11-16(22)12-29-20(31)18-9-14-1-5-27-13-19(14)33-18/h1-6,9-10,13,16,20H,7-8,11-12,14-15H2,(H,28,32)(H,29,30);1-3,6-7,10-11,13,15-16,19H,4-5,8-9,12,14H2,(H,29,32);2-4,7,10,12,14,17H,5-6,8-9,11,13H2,1H3,(H,29,31);1-2,5-6,9-10,13,16H,3-4,7-8,11-12H2,(H,29,31)
InChIKeyVCMSERYMXNGHNA-UHFFFAOYSA-N
XLogP14.89
TPSA386.93 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds19
Heavy Atoms134
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001824.94
LogP ≤ 514.89
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Analyze N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 161260673) is N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is CC(F)(F)c1ccc(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)cn1.O=C(NCC1CC12CCN(C(=O)c1cc(C(F)(F)F)ccn1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1ccc(-c3ccn[nH]3)cc1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1ccc(-n3ccnc3)nc1)CC2)c1cc2ccncc2o1.
What is the InChIKey of N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is VCMSERYMXNGHNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N5O3.C25H24N6O3.C24H24F2N4O3.C23H21F3N4O3/c32-24(22-13-19-5-9-27-16-23(19)34-22)28-15-20-14-26(20)7-11-31(12-8-26)25(33)18-3-1-17(2-4-18)21-6-10-29-30-21;32-23(20-11-17-3-6-26-15-21(17)34-20)29-14-19-12-25(19)4-8-30(9-5-25)24(33)18-1-2-22(28-13-18)31-10-7-27-16-31;1-23(25,26)20-3-2-16(12-28-20)22(32)30-8-5-24(6-9-30)11-17(24)13-29-21(31)18-10-15-4-7-27-14-19(15)33-18;24-23(25,26)15-2-6-28-17(10-15)21(32)30-7-3-22(4-8-30)11-16(22)12-29-20(31)18-9-14-1-5-27-13-19(14)33-18/h1-6,9-10,13,16,20H,7-8,11-12,14-15H2,(H,28,32)(H,29,30);1-3,6-7,10-11,13,15-16,19H,4-5,8-9,12,14H2,(H,29,32);2-4,7,10,12,14,17H,5-6,8-9,11,13H2,1H3,(H,29,31);1-2,5-6,9-10,13,16H,3-4,7-8,11-12H2,(H,29,31).
What are the key properties of N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 1824.94 g/mol, XLogP of 14.89, 19 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[6-(1,1-difluoroethyl)pyridine-3-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(6-imidazol-1-ylpyridine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(1H-pyrazol-5-yl)benzoyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-[4-(trifluoromethyl)pyridine-2-carbonyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 161260673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).