6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole

C72H84Cl5N15O6 — CID 161247156

IUPAC6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole
SMILESCC(C)(O)c1cc(Cl)cc2[nH]ncc12.CC(C)C(O)c1cc(Cl)cc2[nH]ncc12.CC(C)COc1cccc2[nH]ncc12.CCNC(=O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.O=C(CCC1CCCCC1)c1cc(Cl)cc2[nH]ncc12
InChIInChI=1S/C16H19ClN2O.C14H17ClN4O.C11H13ClN2O.C11H14N2O.C10H10ClN3O.C10H11ClN2O/c17-12-8-13(14-10-18-19-15(14)9-12)16(20)7-6-11-4-2-1-3-5-11;1-18(2)14(20)9-3-4-19(8-9)13-6-10(15)5-12-11(13)7-16-17-12;1-6(2)11(15)8-3-7(12)4-10-9(8)5-13-14-10;1-8(2)7-14-11-5-3-4-10-9(11)6-12-13-10;1-2-12-10(15)7-3-6(11)4-9-8(7)5-13-14-9;1-10(2,14)8-3-6(11)4-9-7(8)5-12-13-9/h8-11H,1-7H2,(H,18,19);5-7,9H,3-4,8H2,1-2H3,(H,16,17);3-6,11,15H,1-2H3,(H,13,14);3-6,8H,7H2,1-2H3,(H,12,13);3-5H,2H2,1H3,(H,12,15)(H,13,14);3-5,14H,1-2H3,(H,12,13)
InChIKeyVAUDZBAFCNQGPM-UHFFFAOYSA-N
MW1432.83 g/mol
LogP16.80
Rot. Bonds14

About 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole

6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole (PubChem CID 161247156) has the molecular formula C72H84Cl5N15O6 and a molecular weight of 1432.83 g/mol. Its IUPAC name is 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole.

Molecular Properties

Compound Name6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole
PubChem CID161247156
Molecular FormulaC72H84Cl5N15O6
Molecular Weight1432.83 g/mol
Exact Mass1429.52
IUPAC Name6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole
SMILESCC(C)(O)c1cc(Cl)cc2[nH]ncc12.CC(C)C(O)c1cc(Cl)cc2[nH]ncc12.CC(C)COc1cccc2[nH]ncc12.CCNC(=O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.O=C(CCC1CCCCC1)c1cc(Cl)cc2[nH]ncc12
InChIInChI=1S/C16H19ClN2O.C14H17ClN4O.C11H13ClN2O.C11H14N2O.C10H10ClN3O.C10H11ClN2O/c17-12-8-13(14-10-18-19-15(14)9-12)16(20)7-6-11-4-2-1-3-5-11;1-18(2)14(20)9-3-4-19(8-9)13-6-10(15)5-12-11(13)7-16-17-12;1-6(2)11(15)8-3-7(12)4-10-9(8)5-13-14-10;1-8(2)7-14-11-5-3-4-10-9(11)6-12-13-10;1-2-12-10(15)7-3-6(11)4-9-8(7)5-13-14-9;1-10(2,14)8-3-6(11)4-9-7(8)5-12-13-9/h8-11H,1-7H2,(H,18,19);5-7,9H,3-4,8H2,1-2H3,(H,16,17);3-6,11,15H,1-2H3,(H,13,14);3-6,8H,7H2,1-2H3,(H,12,13);3-5H,2H2,1H3,(H,12,15)(H,13,14);3-5,14H,1-2H3,(H,12,13)
InChIKeyVAUDZBAFCNQGPM-UHFFFAOYSA-N
XLogP16.80
TPSA291.49 Ų
H-Bond Donors9
H-Bond Acceptors13
Rotatable Bonds14
Heavy Atoms98
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001432.83
LogP ≤ 516.80
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1013

Analyze 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole?
The IUPAC name of 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole (CID 161247156) is 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole.
What is the SMILES notation for 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole?
The canonical SMILES for 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole is CC(C)(O)c1cc(Cl)cc2[nH]ncc12.CC(C)C(O)c1cc(Cl)cc2[nH]ncc12.CC(C)COc1cccc2[nH]ncc12.CCNC(=O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)C1CCN(c2cc(Cl)cc3[nH]ncc23)C1.O=C(CCC1CCCCC1)c1cc(Cl)cc2[nH]ncc12.
What is the InChIKey of 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole?
The InChIKey is VAUDZBAFCNQGPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19ClN2O.C14H17ClN4O.C11H13ClN2O.C11H14N2O.C10H10ClN3O.C10H11ClN2O/c17-12-8-13(14-10-18-19-15(14)9-12)16(20)7-6-11-4-2-1-3-5-11;1-18(2)14(20)9-3-4-19(8-9)13-6-10(15)5-12-11(13)7-16-17-12;1-6(2)11(15)8-3-7(12)4-10-9(8)5-13-14-10;1-8(2)7-14-11-5-3-4-10-9(11)6-12-13-10;1-2-12-10(15)7-3-6(11)4-9-8(7)5-13-14-9;1-10(2,14)8-3-6(11)4-9-7(8)5-12-13-9/h8-11H,1-7H2,(H,18,19);5-7,9H,3-4,8H2,1-2H3,(H,16,17);3-6,11,15H,1-2H3,(H,13,14);3-6,8H,7H2,1-2H3,(H,12,13);3-5H,2H2,1H3,(H,12,15)(H,13,14);3-5,14H,1-2H3,(H,12,13).
What are the key properties of 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole?
6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole has a molecular weight of 1432.83 g/mol, XLogP of 16.80, 14 rotatable bonds, 9 hydrogen bond donors, and 13 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-ethyl-1H-indazole-4-carboxamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;1-(6-chloro-1H-indazol-4-yl)-N,N-dimethylpyrrolidine-3-carboxamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol;4-(2-methylpropoxy)-1H-indazole is sourced from PubChem (CID 161247156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).