3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide

C117H123F3N26O18 — CID 157309381

IUPAC3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide
SMILESCn1nc(C(=O)CC2CC(C)(F)C2)c2ccc(NC(=O)c3ccc(F)cn3)cc21.Cn1nc(OCC2CCCC2)c2ccc(NC(=O)c3cccc(F)n3)cc21.Cn1nc(OC[C@@H]2COCCO2)c2ccc(NC(=O)c3ccccn3)cc21.Cn1nc(OC[C@@H]2COCCO2)c2ccc(NC(=O)c3ncccc3N)cc21.Cn1nc(OC[C@H]2COCCO2)c2ccc(NC(=O)c3ncccc3N)cc21.O=C(Nc1ccc2c(OCC3CCCC3)n[nH]c2c1)c1ccccn1
InChIInChI=1S/C21H20F2N4O2.C20H21FN4O2.2C19H21N5O4.C19H20N4O4.C19H20N4O2/c1-21(23)9-12(10-21)7-18(28)19-15-5-4-14(8-17(15)27(2)26-19)25-20(29)16-6-3-13(22)11-24-16;1-25-17-11-14(22-19(26)16-7-4-8-18(21)23-16)9-10-15(17)20(24-25)27-12-13-5-2-3-6-13;2*1-24-16-9-12(22-18(25)17-15(20)3-2-6-21-17)4-5-14(16)19(23-24)28-11-13-10-26-7-8-27-13;1-23-17-10-13(21-18(24)16-4-2-3-7-20-16)5-6-15(17)19(22-23)27-12-14-11-25-8-9-26-14;24-18(16-7-3-4-10-20-16)21-14-8-9-15-17(11-14)22-23-19(15)25-12-13-5-1-2-6-13/h3-6,8,11-12H,7,9-10H2,1-2H3,(H,25,29);4,7-11,13H,2-3,5-6,12H2,1H3,(H,22,26);2*2-6,9,13H,7-8,10-11,20H2,1H3,(H,22,25);2-7,10,14H,8-9,11-12H2,1H3,(H,21,24);3-4,7-11,13H,1-2,5-6,12H2,(H,21,24)(H,22,23)/t;;2*13-;14-;/m..100./s1
InChIKeyBCVYSTJXZSQDSY-BEIVVYOYSA-N
MW2238.43 g/mol
LogP16.99
Rot. Bonds30

About 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide

3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide (PubChem CID 157309381) has the molecular formula C117H123F3N26O18 and a molecular weight of 2238.43 g/mol. Its IUPAC name is 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide.

Molecular Properties

Compound Name3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide
PubChem CID157309381
Molecular FormulaC117H123F3N26O18
Molecular Weight2238.43 g/mol
Exact Mass2236.95
IUPAC Name3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide
SMILESCn1nc(C(=O)CC2CC(C)(F)C2)c2ccc(NC(=O)c3ccc(F)cn3)cc21.Cn1nc(OCC2CCCC2)c2ccc(NC(=O)c3cccc(F)n3)cc21.Cn1nc(OC[C@@H]2COCCO2)c2ccc(NC(=O)c3ccccn3)cc21.Cn1nc(OC[C@@H]2COCCO2)c2ccc(NC(=O)c3ncccc3N)cc21.Cn1nc(OC[C@H]2COCCO2)c2ccc(NC(=O)c3ncccc3N)cc21.O=C(Nc1ccc2c(OCC3CCCC3)n[nH]c2c1)c1ccccn1
InChIInChI=1S/C21H20F2N4O2.C20H21FN4O2.2C19H21N5O4.C19H20N4O4.C19H20N4O2/c1-21(23)9-12(10-21)7-18(28)19-15-5-4-14(8-17(15)27(2)26-19)25-20(29)16-6-3-13(22)11-24-16;1-25-17-11-14(22-19(26)16-7-4-8-18(21)23-16)9-10-15(17)20(24-25)27-12-13-5-2-3-6-13;2*1-24-16-9-12(22-18(25)17-15(20)3-2-6-21-17)4-5-14(16)19(23-24)28-11-13-10-26-7-8-27-13;1-23-17-10-13(21-18(24)16-4-2-3-7-20-16)5-6-15(17)19(22-23)27-12-14-11-25-8-9-26-14;24-18(16-7-3-4-10-20-16)21-14-8-9-15-17(11-14)22-23-19(15)25-12-13-5-1-2-6-13/h3-6,8,11-12H,7,9-10H2,1-2H3,(H,25,29);4,7-11,13H,2-3,5-6,12H2,1H3,(H,22,26);2*2-6,9,13H,7-8,10-11,20H2,1H3,(H,22,25);2-7,10,14H,8-9,11-12H2,1H3,(H,21,24);3-4,7-11,13H,1-2,5-6,12H2,(H,21,24)(H,22,23)/t;;2*13-;14-;/m..100./s1
InChIKeyBCVYSTJXZSQDSY-BEIVVYOYSA-N
XLogP16.99
TPSA540.36 Ų
H-Bond Donors9
H-Bond Acceptors37
Rotatable Bonds30
Heavy Atoms164
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002238.43
LogP ≤ 516.99
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1037

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide?
The IUPAC name of 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide (CID 157309381) is 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide.
What is the SMILES notation for 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide?
The canonical SMILES for 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide is Cn1nc(C(=O)CC2CC(C)(F)C2)c2ccc(NC(=O)c3ccc(F)cn3)cc21.Cn1nc(OCC2CCCC2)c2ccc(NC(=O)c3cccc(F)n3)cc21.Cn1nc(OC[C@@H]2COCCO2)c2ccc(NC(=O)c3ccccn3)cc21.Cn1nc(OC[C@@H]2COCCO2)c2ccc(NC(=O)c3ncccc3N)cc21.Cn1nc(OC[C@H]2COCCO2)c2ccc(NC(=O)c3ncccc3N)cc21.O=C(Nc1ccc2c(OCC3CCCC3)n[nH]c2c1)c1ccccn1.
What is the InChIKey of 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide?
The InChIKey is BCVYSTJXZSQDSY-BEIVVYOYSA-N. The full InChI is InChI=1S/C21H20F2N4O2.C20H21FN4O2.2C19H21N5O4.C19H20N4O4.C19H20N4O2/c1-21(23)9-12(10-21)7-18(28)19-15-5-4-14(8-17(15)27(2)26-19)25-20(29)16-6-3-13(22)11-24-16;1-25-17-11-14(22-19(26)16-7-4-8-18(21)23-16)9-10-15(17)20(24-25)27-12-13-5-2-3-6-13;2*1-24-16-9-12(22-18(25)17-15(20)3-2-6-21-17)4-5-14(16)19(23-24)28-11-13-10-26-7-8-27-13;1-23-17-10-13(21-18(24)16-4-2-3-7-20-16)5-6-15(17)19(22-23)27-12-14-11-25-8-9-26-14;24-18(16-7-3-4-10-20-16)21-14-8-9-15-17(11-14)22-23-19(15)25-12-13-5-1-2-6-13/h3-6,8,11-12H,7,9-10H2,1-2H3,(H,25,29);4,7-11,13H,2-3,5-6,12H2,1H3,(H,22,26);2*2-6,9,13H,7-8,10-11,20H2,1H3,(H,22,25);2-7,10,14H,8-9,11-12H2,1H3,(H,21,24);3-4,7-11,13H,1-2,5-6,12H2,(H,21,24)(H,22,23)/t;;2*13-;14-;/m..100./s1.
What are the key properties of 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide?
3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide has a molecular weight of 2238.43 g/mol, XLogP of 16.99, 30 rotatable bonds, 9 hydrogen bond donors, and 37 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;3-amino-N-[3-[[(2R)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1H-indazol-6-yl]pyridine-2-carboxamide;N-[3-(cyclopentylmethoxy)-1-methylindazol-6-yl]-6-fluoropyridine-2-carboxamide;N-[3-[[(2S)-1,4-dioxan-2-yl]methoxy]-1-methylindazol-6-yl]pyridine-2-carboxamide;5-fluoro-N-[3-[2-(3-fluoro-3-methylcyclobutyl)acetyl]-1-methylindazol-6-yl]pyridine-2-carboxamide is sourced from PubChem (CID 157309381), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).