N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine

C68H72Cl5F2N21O4S — CID 161382775

IUPACN-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine
SMILESCS(=O)(=O)NC1CN(c2cc(Cl)cc3[nH]ncc23)C1.Clc1cc(N2CCC(c3ncco3)CC2)c2cn[nH]c2c1.Cn1ncc2c1CN(c1cc(Cl)cc3[nH]ncc13)CC2.Nc1ccnn1C1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.OC1(c2cc(Cl)cc3[nH]ncc23)CCC(F)(F)CC1
InChIInChI=1S/C15H17ClN6.C15H15ClN4O.C14H14ClN5.C13H13ClF2N2O.C11H13ClN4O2S/c16-10-7-13-12(9-18-20-13)14(8-10)21-5-2-11(3-6-21)22-15(17)1-4-19-22;16-11-7-13-12(9-18-19-13)14(8-11)20-4-1-10(2-5-20)15-17-3-6-21-15;1-19-14-8-20(3-2-9(14)6-17-19)13-5-10(15)4-12-11(13)7-16-18-12;14-8-5-10(9-7-17-18-11(9)6-8)12(19)1-3-13(15,16)4-2-12;1-19(17,18)15-8-5-16(6-8)11-3-7(12)2-10-9(11)4-13-14-10/h1,4,7-9,11H,2-3,5-6,17H2,(H,18,20);3,6-10H,1-2,4-5H2,(H,18,19);4-7H,2-3,8H2,1H3,(H,16,18);5-7,19H,1-4H2,(H,17,18);2-4,8,15H,5-6H2,1H3,(H,13,14)
InChIKeyVRXZMPRFALQCGK-UHFFFAOYSA-N
MW1494.79 g/mol
LogP13.50
Rot. Bonds9

About N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine

N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine (PubChem CID 161382775) has the molecular formula C68H72Cl5F2N21O4S and a molecular weight of 1494.79 g/mol. Its IUPAC name is N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine.

Molecular Properties

Compound NameN-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine
PubChem CID161382775
Molecular FormulaC68H72Cl5F2N21O4S
Molecular Weight1494.79 g/mol
Exact Mass1491.42
IUPAC NameN-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine
SMILESCS(=O)(=O)NC1CN(c2cc(Cl)cc3[nH]ncc23)C1.Clc1cc(N2CCC(c3ncco3)CC2)c2cn[nH]c2c1.Cn1ncc2c1CN(c1cc(Cl)cc3[nH]ncc13)CC2.Nc1ccnn1C1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.OC1(c2cc(Cl)cc3[nH]ncc23)CCC(F)(F)CC1
InChIInChI=1S/C15H17ClN6.C15H15ClN4O.C14H14ClN5.C13H13ClF2N2O.C11H13ClN4O2S/c16-10-7-13-12(9-18-20-13)14(8-10)21-5-2-11(3-6-21)22-15(17)1-4-19-22;16-11-7-13-12(9-18-19-13)14(8-11)20-4-1-10(2-5-20)15-17-3-6-21-15;1-19-14-8-20(3-2-9(14)6-17-19)13-5-10(15)4-12-11(13)7-16-18-12;14-8-5-10(9-7-17-18-11(9)6-8)12(19)1-3-13(15,16)4-2-12;1-19(17,18)15-8-5-16(6-8)11-3-7(12)2-10-9(11)4-13-14-10/h1,4,7-9,11H,2-3,5-6,17H2,(H,18,20);3,6-10H,1-2,4-5H2,(H,18,19);4-7H,2-3,8H2,1H3,(H,16,18);5-7,19H,1-4H2,(H,17,18);2-4,8,15H,5-6H2,1H3,(H,13,14)
InChIKeyVRXZMPRFALQCGK-UHFFFAOYSA-N
XLogP13.50
TPSA310.45 Ų
H-Bond Donors8
H-Bond Acceptors19
Rotatable Bonds9
Heavy Atoms101
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001494.79
LogP ≤ 513.50
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1019

Analyze N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine?
The IUPAC name of N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine (CID 161382775) is N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine.
What is the SMILES notation for N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine?
The canonical SMILES for N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine is CS(=O)(=O)NC1CN(c2cc(Cl)cc3[nH]ncc23)C1.Clc1cc(N2CCC(c3ncco3)CC2)c2cn[nH]c2c1.Cn1ncc2c1CN(c1cc(Cl)cc3[nH]ncc13)CC2.Nc1ccnn1C1CCN(c2cc(Cl)cc3[nH]ncc23)CC1.OC1(c2cc(Cl)cc3[nH]ncc23)CCC(F)(F)CC1.
What is the InChIKey of N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine?
The InChIKey is VRXZMPRFALQCGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17ClN6.C15H15ClN4O.C14H14ClN5.C13H13ClF2N2O.C11H13ClN4O2S/c16-10-7-13-12(9-18-20-13)14(8-10)21-5-2-11(3-6-21)22-15(17)1-4-19-22;16-11-7-13-12(9-18-19-13)14(8-11)20-4-1-10(2-5-20)15-17-3-6-21-15;1-19-14-8-20(3-2-9(14)6-17-19)13-5-10(15)4-12-11(13)7-16-18-12;14-8-5-10(9-7-17-18-11(9)6-8)12(19)1-3-13(15,16)4-2-12;1-19(17,18)15-8-5-16(6-8)11-3-7(12)2-10-9(11)4-13-14-10/h1,4,7-9,11H,2-3,5-6,17H2,(H,18,20);3,6-10H,1-2,4-5H2,(H,18,19);4-7H,2-3,8H2,1H3,(H,16,18);5-7,19H,1-4H2,(H,17,18);2-4,8,15H,5-6H2,1H3,(H,13,14).
What are the key properties of N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine?
N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine has a molecular weight of 1494.79 g/mol, XLogP of 13.50, 9 rotatable bonds, 8 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(6-chloro-1H-indazol-4-yl)azetidin-3-yl]methanesulfonamide;1-(6-chloro-1H-indazol-4-yl)-4,4-difluorocyclohexan-1-ol;6-(6-chloro-1H-indazol-4-yl)-1-methyl-5,7-dihydro-4H-pyrazolo[5,4-c]pyridine;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]-1,3-oxazole;2-[1-(6-chloro-1H-indazol-4-yl)piperidin-4-yl]pyrazol-3-amine is sourced from PubChem (CID 161382775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).