3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide

C115H95Cl5FN33O7 — CID 158094222

IUPAC3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide
SMILESCN1CCC(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)C1.CN1CCC(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)CC1=O.Cn1ccc(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)c1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)NC1COC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C24H16ClFN6O.C24H22ClN7O2.C23H22ClN7O.C23H18ClN7O.C21H17ClN6O2/c25-18-11-14(10-15-12-28-32-19(15)18)21-20(13-4-2-1-3-5-13)31-23(27)22(30-21)24(33)29-17-8-6-16(26)7-9-17;1-32-8-7-16(11-18(32)33)28-24(34)22-23(26)30-20(13-5-3-2-4-6-13)21(29-22)14-9-15-12-27-31-19(15)17(25)10-14;2*1-31-8-7-16(12-31)27-23(32)21-22(25)29-19(13-5-3-2-4-6-13)20(28-21)14-9-15-11-26-30-18(15)17(24)10-14;22-15-7-12(6-13-8-24-28-16(13)15)18-17(11-4-2-1-3-5-11)27-20(23)19(26-18)21(29)25-14-9-30-10-14/h1-12H,(H2,27,31)(H,28,32)(H,29,33);2-6,9-10,12,16H,7-8,11H2,1H3,(H2,26,30)(H,27,31)(H,28,34);2-6,9-11,16H,7-8,12H2,1H3,(H2,25,29)(H,26,30)(H,27,32);2-12H,1H3,(H2,25,29)(H,26,30)(H,27,32);1-8,14H,9-10H2,(H2,23,27)(H,24,28)(H,25,29)
InChIKeyFOMAWSDPBABGKQ-UHFFFAOYSA-N
MW2247.51 g/mol
LogP19.51
Rot. Bonds20

About 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide

3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide (PubChem CID 158094222) has the molecular formula C115H95Cl5FN33O7 and a molecular weight of 2247.51 g/mol. Its IUPAC name is 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide.

Molecular Properties

Compound Name3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide
PubChem CID158094222
Molecular FormulaC115H95Cl5FN33O7
Molecular Weight2247.51 g/mol
Exact Mass2243.65
IUPAC Name3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide
SMILESCN1CCC(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)C1.CN1CCC(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)CC1=O.Cn1ccc(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)c1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)NC1COC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)Nc1ccc(F)cc1
InChIInChI=1S/C24H16ClFN6O.C24H22ClN7O2.C23H22ClN7O.C23H18ClN7O.C21H17ClN6O2/c25-18-11-14(10-15-12-28-32-19(15)18)21-20(13-4-2-1-3-5-13)31-23(27)22(30-21)24(33)29-17-8-6-16(26)7-9-17;1-32-8-7-16(11-18(32)33)28-24(34)22-23(26)30-20(13-5-3-2-4-6-13)21(29-22)14-9-15-12-27-31-19(15)17(25)10-14;2*1-31-8-7-16(12-31)27-23(32)21-22(25)29-19(13-5-3-2-4-6-13)20(28-21)14-9-15-11-26-30-18(15)17(24)10-14;22-15-7-12(6-13-8-24-28-16(13)15)18-17(11-4-2-1-3-5-11)27-20(23)19(26-18)21(29)25-14-9-30-10-14/h1-12H,(H2,27,31)(H,28,32)(H,29,33);2-6,9-10,12,16H,7-8,11H2,1H3,(H2,26,30)(H,27,31)(H,28,34);2-6,9-11,16H,7-8,12H2,1H3,(H2,25,29)(H,26,30)(H,27,32);2-12H,1H3,(H2,25,29)(H,26,30)(H,27,32);1-8,14H,9-10H2,(H2,23,27)(H,24,28)(H,25,29)
InChIKeyFOMAWSDPBABGKQ-UHFFFAOYSA-N
XLogP19.51
TPSA585.61 Ų
H-Bond Donors15
H-Bond Acceptors29
Rotatable Bonds20
Heavy Atoms161
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002247.51
LogP ≤ 519.51
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1029

Analyze 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide?
The IUPAC name of 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide (CID 158094222) is 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide.
What is the SMILES notation for 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide?
The canonical SMILES for 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide is CN1CCC(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)C1.CN1CCC(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)CC1=O.Cn1ccc(NC(=O)c2nc(-c3cc(Cl)c4[nH]ncc4c3)c(-c3ccccc3)nc2N)c1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)NC1COC1.Nc1nc(-c2ccccc2)c(-c2cc(Cl)c3[nH]ncc3c2)nc1C(=O)Nc1ccc(F)cc1.
What is the InChIKey of 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide?
The InChIKey is FOMAWSDPBABGKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16ClFN6O.C24H22ClN7O2.C23H22ClN7O.C23H18ClN7O.C21H17ClN6O2/c25-18-11-14(10-15-12-28-32-19(15)18)21-20(13-4-2-1-3-5-13)31-23(27)22(30-21)24(33)29-17-8-6-16(26)7-9-17;1-32-8-7-16(11-18(32)33)28-24(34)22-23(26)30-20(13-5-3-2-4-6-13)21(29-22)14-9-15-12-27-31-19(15)17(25)10-14;2*1-31-8-7-16(12-31)27-23(32)21-22(25)29-19(13-5-3-2-4-6-13)20(28-21)14-9-15-11-26-30-18(15)17(24)10-14;22-15-7-12(6-13-8-24-28-16(13)15)18-17(11-4-2-1-3-5-11)27-20(23)19(26-18)21(29)25-14-9-30-10-14/h1-12H,(H2,27,31)(H,28,32)(H,29,33);2-6,9-10,12,16H,7-8,11H2,1H3,(H2,26,30)(H,27,31)(H,28,34);2-6,9-11,16H,7-8,12H2,1H3,(H2,25,29)(H,26,30)(H,27,32);2-12H,1H3,(H2,25,29)(H,26,30)(H,27,32);1-8,14H,9-10H2,(H2,23,27)(H,24,28)(H,25,29).
What are the key properties of 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide?
3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide has a molecular weight of 2247.51 g/mol, XLogP of 19.51, 20 rotatable bonds, 15 hydrogen bond donors, and 29 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(4-fluorophenyl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methyl-2-oxopiperidin-4-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrolidin-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(1-methylpyrrol-3-yl)-5-phenylpyrazine-2-carboxamide;3-amino-6-(7-chloro-1H-indazol-5-yl)-N-(oxetan-3-yl)-5-phenylpyrazine-2-carboxamide is sourced from PubChem (CID 158094222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).