N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine

C88H74ClF9N22O — CID 159662450

IUPACN-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine
SMILESClc1ccccc1-c1cc(-c2ccncc2)cc(Nc2n[nH]c3ccccc23)n1.FC(F)(F)c1ccccc1-c1cc(N2CCNCC2)cc(Nc2n[nH]c3ccccc23)n1.NCCNc1cc(Nc2n[nH]c3ccccc23)nc(-c2ccccc2C(F)(F)F)c1.NCCOc1cc(Nc2n[nH]c3ccccc23)nc(-c2ccccc2C(F)(F)F)c1
InChIInChI=1S/C23H16ClN5.C23H21F3N6.C21H19F3N6.C21H18F3N5O/c24-19-7-3-1-5-17(19)21-13-16(15-9-11-25-12-10-15)14-22(26-21)27-23-18-6-2-4-8-20(18)28-29-23;24-23(25,26)18-7-3-1-5-16(18)20-13-15(32-11-9-27-10-12-32)14-21(28-20)29-22-17-6-2-4-8-19(17)30-31-22;22-21(23,24)16-7-3-1-5-14(16)18-11-13(26-10-9-25)12-19(27-18)28-20-15-6-2-4-8-17(15)29-30-20;22-21(23,24)16-7-3-1-5-14(16)18-11-13(30-10-9-25)12-19(26-18)27-20-15-6-2-4-8-17(15)28-29-20/h1-14H,(H2,26,27,28,29);1-8,13-14,27H,9-12H2,(H2,28,29,30,31);1-8,11-12H,9-10,25H2,(H3,26,27,28,29,30);1-8,11-12H,9-10,25H2,(H2,26,27,28,29)
InChIKeyMSZIJSBIVLESBT-UHFFFAOYSA-N
MW1662.15 g/mol
LogP20.36
Rot. Bonds20

About N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine

N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine (PubChem CID 159662450) has the molecular formula C88H74ClF9N22O and a molecular weight of 1662.15 g/mol. Its IUPAC name is N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine.

Molecular Properties

Compound NameN-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine
PubChem CID159662450
Molecular FormulaC88H74ClF9N22O
Molecular Weight1662.15 g/mol
Exact Mass1660.60
IUPAC NameN-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine
SMILESClc1ccccc1-c1cc(-c2ccncc2)cc(Nc2n[nH]c3ccccc23)n1.FC(F)(F)c1ccccc1-c1cc(N2CCNCC2)cc(Nc2n[nH]c3ccccc23)n1.NCCNc1cc(Nc2n[nH]c3ccccc23)nc(-c2ccccc2C(F)(F)F)c1.NCCOc1cc(Nc2n[nH]c3ccccc23)nc(-c2ccccc2C(F)(F)F)c1
InChIInChI=1S/C23H16ClN5.C23H21F3N6.C21H19F3N6.C21H18F3N5O/c24-19-7-3-1-5-17(19)21-13-16(15-9-11-25-12-10-15)14-22(26-21)27-23-18-6-2-4-8-20(18)28-29-23;24-23(25,26)18-7-3-1-5-16(18)20-13-15(32-11-9-27-10-12-32)14-21(28-20)29-22-17-6-2-4-8-19(17)30-31-22;22-21(23,24)16-7-3-1-5-14(16)18-11-13(26-10-9-25)12-19(27-18)28-20-15-6-2-4-8-17(15)29-30-20;22-21(23,24)16-7-3-1-5-14(16)18-11-13(30-10-9-25)12-19(26-18)27-20-15-6-2-4-8-17(15)28-29-20/h1-14H,(H2,26,27,28,29);1-8,13-14,27H,9-12H2,(H2,28,29,30,31);1-8,11-12H,9-10,25H2,(H3,26,27,28,29,30);1-8,11-12H,9-10,25H2,(H2,26,27,28,29)
InChIKeyMSZIJSBIVLESBT-UHFFFAOYSA-N
XLogP20.36
TPSA315.86 Ų
H-Bond Donors12
H-Bond Acceptors19
Rotatable Bonds20
Heavy Atoms121
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001662.15
LogP ≤ 520.36
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1019

Analyze N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine?
The IUPAC name of N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine (CID 159662450) is N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine.
What is the SMILES notation for N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine?
The canonical SMILES for N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine is Clc1ccccc1-c1cc(-c2ccncc2)cc(Nc2n[nH]c3ccccc23)n1.FC(F)(F)c1ccccc1-c1cc(N2CCNCC2)cc(Nc2n[nH]c3ccccc23)n1.NCCNc1cc(Nc2n[nH]c3ccccc23)nc(-c2ccccc2C(F)(F)F)c1.NCCOc1cc(Nc2n[nH]c3ccccc23)nc(-c2ccccc2C(F)(F)F)c1.
What is the InChIKey of N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine?
The InChIKey is MSZIJSBIVLESBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16ClN5.C23H21F3N6.C21H19F3N6.C21H18F3N5O/c24-19-7-3-1-5-17(19)21-13-16(15-9-11-25-12-10-15)14-22(26-21)27-23-18-6-2-4-8-20(18)28-29-23;24-23(25,26)18-7-3-1-5-16(18)20-13-15(32-11-9-27-10-12-32)14-21(28-20)29-22-17-6-2-4-8-19(17)30-31-22;22-21(23,24)16-7-3-1-5-14(16)18-11-13(26-10-9-25)12-19(27-18)28-20-15-6-2-4-8-17(15)29-30-20;22-21(23,24)16-7-3-1-5-14(16)18-11-13(30-10-9-25)12-19(26-18)27-20-15-6-2-4-8-17(15)28-29-20/h1-14H,(H2,26,27,28,29);1-8,13-14,27H,9-12H2,(H2,28,29,30,31);1-8,11-12H,9-10,25H2,(H3,26,27,28,29,30);1-8,11-12H,9-10,25H2,(H2,26,27,28,29).
What are the key properties of N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine?
N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine has a molecular weight of 1662.15 g/mol, XLogP of 20.36, 20 rotatable bonds, 12 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-aminoethoxy)-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine;4-N-(2-aminoethyl)-2-N-(1H-indazol-3-yl)-6-[2-(trifluoromethyl)phenyl]pyridine-2,4-diamine;N-[6-(2-chlorophenyl)-4-pyridin-4-yl-2-pyridinyl]-1H-indazol-3-amine;N-[4-piperazin-1-yl-6-[2-(trifluoromethyl)phenyl]-2-pyridinyl]-1H-indazol-3-amine is sourced from PubChem (CID 159662450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).