4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol

C82H79Cl6N15O6 — CID 158819024

IUPAC4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol
SMILESCC(C)(O)c1cc(Cl)cc2[nH]ncc12.CC(C)C(O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.CNC(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.NC(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.O=C(CCC1CCCCC1)c1cc(Cl)cc2[nH]ncc12
InChIInChI=1S/C16H14ClN3O.C16H19ClN2O.C15H12ClN3O.C14H10ClN3O.C11H13ClN2O.C10H11ClN2O/c1-20(2)16(21)11-5-3-10(4-6-11)13-7-12(17)8-15-14(13)9-18-19-15;17-12-8-13(14-10-18-19-15(14)9-12)16(20)7-6-11-4-2-1-3-5-11;1-17-15(20)10-4-2-9(3-5-10)12-6-11(16)7-14-13(12)8-18-19-14;15-10-5-11(12-7-17-18-13(12)6-10)8-1-3-9(4-2-8)14(16)19;1-6(2)11(15)8-3-7(12)4-10-9(8)5-13-14-10;1-10(2,14)8-3-6(11)4-9-7(8)5-12-13-9/h3-9H,1-2H3,(H,18,19);8-11H,1-7H2,(H,18,19);2-8H,1H3,(H,17,20)(H,18,19);1-7H,(H2,16,19)(H,17,18);3-6,11,15H,1-2H3,(H,13,14);3-5,14H,1-2H3,(H,12,13)
InChIKeyIVPZNMJBTJYWJZ-UHFFFAOYSA-N
MW1583.35 g/mol
LogP19.92
Rot. Bonds13

About 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol

4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol (PubChem CID 158819024) has the molecular formula C82H79Cl6N15O6 and a molecular weight of 1583.35 g/mol. Its IUPAC name is 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol.

Molecular Properties

Compound Name4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol
PubChem CID158819024
Molecular FormulaC82H79Cl6N15O6
Molecular Weight1583.35 g/mol
Exact Mass1579.45
IUPAC Name4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol
SMILESCC(C)(O)c1cc(Cl)cc2[nH]ncc12.CC(C)C(O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.CNC(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.NC(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.O=C(CCC1CCCCC1)c1cc(Cl)cc2[nH]ncc12
InChIInChI=1S/C16H14ClN3O.C16H19ClN2O.C15H12ClN3O.C14H10ClN3O.C11H13ClN2O.C10H11ClN2O/c1-20(2)16(21)11-5-3-10(4-6-11)13-7-12(17)8-15-14(13)9-18-19-15;17-12-8-13(14-10-18-19-15(14)9-12)16(20)7-6-11-4-2-1-3-5-11;1-17-15(20)10-4-2-9(3-5-10)12-6-11(16)7-14-13(12)8-18-19-14;15-10-5-11(12-7-17-18-13(12)6-10)8-1-3-9(4-2-8)14(16)19;1-6(2)11(15)8-3-7(12)4-10-9(8)5-13-14-10;1-10(2,14)8-3-6(11)4-9-7(8)5-12-13-9/h3-9H,1-2H3,(H,18,19);8-11H,1-7H2,(H,18,19);2-8H,1H3,(H,17,20)(H,18,19);1-7H,(H2,16,19)(H,17,18);3-6,11,15H,1-2H3,(H,13,14);3-5,14H,1-2H3,(H,12,13)
InChIKeyIVPZNMJBTJYWJZ-UHFFFAOYSA-N
XLogP19.92
TPSA322.11 Ų
H-Bond Donors10
H-Bond Acceptors12
Rotatable Bonds13
Heavy Atoms109
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001583.35
LogP ≤ 519.92
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1012

Analyze 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol?
The IUPAC name of 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol (CID 158819024) is 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol.
What is the SMILES notation for 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol?
The canonical SMILES for 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol is CC(C)(O)c1cc(Cl)cc2[nH]ncc12.CC(C)C(O)c1cc(Cl)cc2[nH]ncc12.CN(C)C(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.CNC(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.NC(=O)c1ccc(-c2cc(Cl)cc3[nH]ncc23)cc1.O=C(CCC1CCCCC1)c1cc(Cl)cc2[nH]ncc12.
What is the InChIKey of 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol?
The InChIKey is IVPZNMJBTJYWJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14ClN3O.C16H19ClN2O.C15H12ClN3O.C14H10ClN3O.C11H13ClN2O.C10H11ClN2O/c1-20(2)16(21)11-5-3-10(4-6-11)13-7-12(17)8-15-14(13)9-18-19-15;17-12-8-13(14-10-18-19-15(14)9-12)16(20)7-6-11-4-2-1-3-5-11;1-17-15(20)10-4-2-9(3-5-10)12-6-11(16)7-14-13(12)8-18-19-14;15-10-5-11(12-7-17-18-13(12)6-10)8-1-3-9(4-2-8)14(16)19;1-6(2)11(15)8-3-7(12)4-10-9(8)5-13-14-10;1-10(2,14)8-3-6(11)4-9-7(8)5-12-13-9/h3-9H,1-2H3,(H,18,19);8-11H,1-7H2,(H,18,19);2-8H,1H3,(H,17,20)(H,18,19);1-7H,(H2,16,19)(H,17,18);3-6,11,15H,1-2H3,(H,13,14);3-5,14H,1-2H3,(H,12,13).
What are the key properties of 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol?
4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol has a molecular weight of 1583.35 g/mol, XLogP of 19.92, 13 rotatable bonds, 10 hydrogen bond donors, and 12 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(6-chloro-1H-indazol-4-yl)benzamide;1-(6-chloro-1H-indazol-4-yl)-3-cyclohexylpropan-1-one;4-(6-chloro-1H-indazol-4-yl)-N,N-dimethylbenzamide;4-(6-chloro-1H-indazol-4-yl)-N-methylbenzamide;1-(6-chloro-1H-indazol-4-yl)-2-methylpropan-1-ol;2-(6-chloro-1H-indazol-4-yl)propan-2-ol is sourced from PubChem (CID 158819024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).