N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

C96H95N19O11 — CID 159168599

IUPACN-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESC=C(c1ccc2n[nH]nc2c1)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1.Cc1ccnc(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)c1.O=C(NCC1CC12CCN(C(=O)c1cc3cccn3cn1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1cccc3c1N=CC3)CC2)c1cc2ccncc2o1
InChIInChI=1S/C25H24N4O3.C24H24N6O2.C24H23N5O3.C23H24N4O3/c30-23(20-12-17-4-8-26-15-21(17)32-20)28-14-18-13-25(18)6-10-29(11-7-25)24(31)19-3-1-2-16-5-9-27-22(16)19;1-15(16-2-3-19-20(10-16)28-29-27-19)30-8-5-24(6-9-30)12-18(24)13-26-23(31)21-11-17-4-7-25-14-22(17)32-21;30-22(20-10-16-3-6-25-14-21(16)32-20)26-13-17-12-24(17)4-8-28(9-5-24)23(31)19-11-18-2-1-7-29(18)15-27-19;1-15-2-7-25-18(10-15)22(29)27-8-4-23(5-9-27)12-17(23)13-26-21(28)19-11-16-3-6-24-14-20(16)30-19/h1-4,8-9,12,15,18H,5-7,10-11,13-14H2,(H,28,30);2-4,7,10-11,14,18H,1,5-6,8-9,12-13H2,(H,26,31)(H,27,28,29);1-3,6-7,10-11,14-15,17H,4-5,8-9,12-13H2,(H,26,30);2-3,6-7,10-11,14,17H,4-5,8-9,12-13H2,1H3,(H,26,28)
InChIKeyKLJWMHSKDWYNAO-UHFFFAOYSA-N
MW1690.94 g/mol
LogP13.71
Rot. Bonds17

About N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide

N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (PubChem CID 159168599) has the molecular formula C96H95N19O11 and a molecular weight of 1690.94 g/mol. Its IUPAC name is N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
PubChem CID159168599
Molecular FormulaC96H95N19O11
Molecular Weight1690.94 g/mol
Exact Mass1689.75
IUPAC NameN-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide
SMILESC=C(c1ccc2n[nH]nc2c1)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1.Cc1ccnc(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)c1.O=C(NCC1CC12CCN(C(=O)c1cc3cccn3cn1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1cccc3c1N=CC3)CC2)c1cc2ccncc2o1
InChIInChI=1S/C25H24N4O3.C24H24N6O2.C24H23N5O3.C23H24N4O3/c30-23(20-12-17-4-8-26-15-21(17)32-20)28-14-18-13-25(18)6-10-29(11-7-25)24(31)19-3-1-2-16-5-9-27-22(16)19;1-15(16-2-3-19-20(10-16)28-29-27-19)30-8-5-24(6-9-30)12-18(24)13-26-23(31)21-11-17-4-7-25-14-22(17)32-21;30-22(20-10-16-3-6-25-14-21(16)32-20)26-13-17-12-24(17)4-8-28(9-5-24)23(31)19-11-18-2-1-7-29(18)15-27-19;1-15-2-7-25-18(10-15)22(29)27-8-4-23(5-9-27)12-17(23)13-26-21(28)19-11-16-3-6-24-14-20(16)30-19/h1-4,8-9,12,15,18H,5-7,10-11,13-14H2,(H,28,30);2-4,7,10-11,14,18H,1,5-6,8-9,12-13H2,(H,26,31)(H,27,28,29);1-3,6-7,10-11,14-15,17H,4-5,8-9,12-13H2,(H,26,30);2-3,6-7,10-11,14,17H,4-5,8-9,12-13H2,1H3,(H,26,28)
InChIKeyKLJWMHSKDWYNAO-UHFFFAOYSA-N
XLogP13.71
TPSA368.81 Ų
H-Bond Donors5
H-Bond Acceptors22
Rotatable Bonds17
Heavy Atoms126
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001690.94
LogP ≤ 513.71
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 1022

Analyze N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-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-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The IUPAC name of N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide (CID 159168599) is N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide.
What is the SMILES notation for N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The canonical SMILES for N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is C=C(c1ccc2n[nH]nc2c1)N1CCC2(CC1)CC2CNC(=O)c1cc2ccncc2o1.Cc1ccnc(C(=O)N2CCC3(CC2)CC3CNC(=O)c2cc3ccncc3o2)c1.O=C(NCC1CC12CCN(C(=O)c1cc3cccn3cn1)CC2)c1cc2ccncc2o1.O=C(NCC1CC12CCN(C(=O)c1cccc3c1N=CC3)CC2)c1cc2ccncc2o1.
What is the InChIKey of N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
The InChIKey is KLJWMHSKDWYNAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O3.C24H24N6O2.C24H23N5O3.C23H24N4O3/c30-23(20-12-17-4-8-26-15-21(17)32-20)28-14-18-13-25(18)6-10-29(11-7-25)24(31)19-3-1-2-16-5-9-27-22(16)19;1-15(16-2-3-19-20(10-16)28-29-27-19)30-8-5-24(6-9-30)12-18(24)13-26-23(31)21-11-17-4-7-25-14-22(17)32-21;30-22(20-10-16-3-6-25-14-21(16)32-20)26-13-17-12-24(17)4-8-28(9-5-24)23(31)19-11-18-2-1-7-29(18)15-27-19;1-15-2-7-25-18(10-15)22(29)27-8-4-23(5-9-27)12-17(23)13-26-21(28)19-11-16-3-6-24-14-20(16)30-19/h1-4,8-9,12,15,18H,5-7,10-11,13-14H2,(H,28,30);2-4,7,10-11,14,18H,1,5-6,8-9,12-13H2,(H,26,31)(H,27,28,29);1-3,6-7,10-11,14-15,17H,4-5,8-9,12-13H2,(H,26,30);2-3,6-7,10-11,14,17H,4-5,8-9,12-13H2,1H3,(H,26,28).
What are the key properties of N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide?
N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide has a molecular weight of 1690.94 g/mol, XLogP of 13.71, 17 rotatable bonds, 5 hydrogen bond donors, and 22 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[6-[1-(2H-benzotriazol-5-yl)ethenyl]-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(3H-indole-7-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(4-methylpyridine-2-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide;N-[[6-(pyrrolo[1,2-c]pyrimidine-3-carbonyl)-6-azaspiro[2.5]octan-2-yl]methyl]furo[2,3-c]pyridine-2-carboxamide is sourced from PubChem (CID 159168599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).