5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine

C143H179ClF2N26O — CID 160893202

IUPAC5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine
SMILESCC(C)(C)c1cc2cn[nH]c2cc1F.CC(C)(C)c1ccc(-c2cn[nH]c2)cc1.CC(C)(C)c1ccc(-c2cn[nH]c2)cn1.CC(C)(C)c1ccc(-c2cn[nH]c2)nc1.CC(C)(C)c1ccc2[nH]ncc2c1.CC(C)(C)c1ccc2[nH]ncc2c1Cl.CC(C)(C)c1ccc2[nH]ncc2c1F.CC(C)(C)c1ccc2cn[nH]c2c1.CC(C)(C)c1cccc(-c2cn[nH]c2)c1.COc1cc(C(C)(C)C)ccc1-c1cn[nH]c1.Cc1[nH]nc2ccc(C(C)(C)C)cc12.Cc1c(C(C)(C)C)ccc2[nH]ncc12
InChIInChI=1S/C14H18N2O.2C13H16N2.2C12H15N3.2C12H16N2.C11H13ClN2.2C11H13FN2.2C11H14N2/c1-14(2,3)11-5-6-12(13(7-11)17-4)10-8-15-16-9-10;1-13(2,3)12-6-4-10(5-7-12)11-8-14-15-9-11;1-13(2,3)12-6-4-5-10(7-12)11-8-14-15-9-11;1-12(2,3)10-4-5-11(13-8-10)9-6-14-15-7-9;1-12(2,3)11-5-4-9(6-13-11)10-7-14-15-8-10;1-8-9-7-13-14-11(9)6-5-10(8)12(2,3)4;1-8-10-7-9(12(2,3)4)5-6-11(10)14-13-8;1-11(2,3)8-4-5-9-7(10(8)12)6-13-14-9;1-11(2,3)8-4-7-6-13-14-10(7)5-9(8)12;1-11(2,3)8-4-5-9-7(10(8)12)6-13-14-9;1-11(2,3)9-4-5-10-8(6-9)7-12-13-10;1-11(2,3)9-5-4-8-7-12-13-10(8)6-9/h5-9H,1-4H3,(H,15,16);2*4-9H,1-3H3,(H,14,15);2*4-8H,1-3H3,(H,14,15);2*5-7H,1-4H3,(H,13,14);3*4-6H,1-3H3,(H,13,14);2*4-7H,1-3H3,(H,12,13)
InChIKeySONSVXDYLCZDEM-UHFFFAOYSA-N
MW2351.63 g/mol
LogP37.24
Rot. Bonds6

About 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine

5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine (PubChem CID 160893202) has the molecular formula C143H179ClF2N26O and a molecular weight of 2351.63 g/mol. Its IUPAC name is 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine.

Molecular Properties

Compound Name5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine
PubChem CID160893202
Molecular FormulaC143H179ClF2N26O
Molecular Weight2351.63 g/mol
Exact Mass2349.44
IUPAC Name5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine
SMILESCC(C)(C)c1cc2cn[nH]c2cc1F.CC(C)(C)c1ccc(-c2cn[nH]c2)cc1.CC(C)(C)c1ccc(-c2cn[nH]c2)cn1.CC(C)(C)c1ccc(-c2cn[nH]c2)nc1.CC(C)(C)c1ccc2[nH]ncc2c1.CC(C)(C)c1ccc2[nH]ncc2c1Cl.CC(C)(C)c1ccc2[nH]ncc2c1F.CC(C)(C)c1ccc2cn[nH]c2c1.CC(C)(C)c1cccc(-c2cn[nH]c2)c1.COc1cc(C(C)(C)C)ccc1-c1cn[nH]c1.Cc1[nH]nc2ccc(C(C)(C)C)cc12.Cc1c(C(C)(C)C)ccc2[nH]ncc12
InChIInChI=1S/C14H18N2O.2C13H16N2.2C12H15N3.2C12H16N2.C11H13ClN2.2C11H13FN2.2C11H14N2/c1-14(2,3)11-5-6-12(13(7-11)17-4)10-8-15-16-9-10;1-13(2,3)12-6-4-10(5-7-12)11-8-14-15-9-11;1-13(2,3)12-6-4-5-10(7-12)11-8-14-15-9-11;1-12(2,3)10-4-5-11(13-8-10)9-6-14-15-7-9;1-12(2,3)11-5-4-9(6-13-11)10-7-14-15-8-10;1-8-9-7-13-14-11(9)6-5-10(8)12(2,3)4;1-8-10-7-9(12(2,3)4)5-6-11(10)14-13-8;1-11(2,3)8-4-5-9-7(10(8)12)6-13-14-9;1-11(2,3)8-4-7-6-13-14-10(7)5-9(8)12;1-11(2,3)8-4-5-9-7(10(8)12)6-13-14-9;1-11(2,3)9-4-5-10-8(6-9)7-12-13-10;1-11(2,3)9-5-4-8-7-12-13-10(8)6-9/h5-9H,1-4H3,(H,15,16);2*4-9H,1-3H3,(H,14,15);2*4-8H,1-3H3,(H,14,15);2*5-7H,1-4H3,(H,13,14);3*4-6H,1-3H3,(H,13,14);2*4-7H,1-3H3,(H,12,13)
InChIKeySONSVXDYLCZDEM-UHFFFAOYSA-N
XLogP37.24
TPSA379.17 Ų
H-Bond Donors12
H-Bond Acceptors15
Rotatable Bonds6
Heavy Atoms173
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002351.63
LogP ≤ 537.24
H-Bond Donors ≤ 512
H-Bond Acceptors ≤ 1015

Analyze 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine?
The IUPAC name of 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine (CID 160893202) is 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine.
What is the SMILES notation for 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine?
The canonical SMILES for 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine is CC(C)(C)c1cc2cn[nH]c2cc1F.CC(C)(C)c1ccc(-c2cn[nH]c2)cc1.CC(C)(C)c1ccc(-c2cn[nH]c2)cn1.CC(C)(C)c1ccc(-c2cn[nH]c2)nc1.CC(C)(C)c1ccc2[nH]ncc2c1.CC(C)(C)c1ccc2[nH]ncc2c1Cl.CC(C)(C)c1ccc2[nH]ncc2c1F.CC(C)(C)c1ccc2cn[nH]c2c1.CC(C)(C)c1cccc(-c2cn[nH]c2)c1.COc1cc(C(C)(C)C)ccc1-c1cn[nH]c1.Cc1[nH]nc2ccc(C(C)(C)C)cc12.Cc1c(C(C)(C)C)ccc2[nH]ncc12.
What is the InChIKey of 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine?
The InChIKey is SONSVXDYLCZDEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O.2C13H16N2.2C12H15N3.2C12H16N2.C11H13ClN2.2C11H13FN2.2C11H14N2/c1-14(2,3)11-5-6-12(13(7-11)17-4)10-8-15-16-9-10;1-13(2,3)12-6-4-10(5-7-12)11-8-14-15-9-11;1-13(2,3)12-6-4-5-10(7-12)11-8-14-15-9-11;1-12(2,3)10-4-5-11(13-8-10)9-6-14-15-7-9;1-12(2,3)11-5-4-9(6-13-11)10-7-14-15-8-10;1-8-9-7-13-14-11(9)6-5-10(8)12(2,3)4;1-8-10-7-9(12(2,3)4)5-6-11(10)14-13-8;1-11(2,3)8-4-5-9-7(10(8)12)6-13-14-9;1-11(2,3)8-4-7-6-13-14-10(7)5-9(8)12;1-11(2,3)8-4-5-9-7(10(8)12)6-13-14-9;1-11(2,3)9-4-5-10-8(6-9)7-12-13-10;1-11(2,3)9-5-4-8-7-12-13-10(8)6-9/h5-9H,1-4H3,(H,15,16);2*4-9H,1-3H3,(H,14,15);2*4-8H,1-3H3,(H,14,15);2*5-7H,1-4H3,(H,13,14);3*4-6H,1-3H3,(H,13,14);2*4-7H,1-3H3,(H,12,13).
What are the key properties of 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine?
5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine has a molecular weight of 2351.63 g/mol, XLogP of 37.24, 6 rotatable bonds, 12 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-4-chloro-1H-indazole;5-tert-butyl-4-fluoro-1H-indazole;5-tert-butyl-6-fluoro-1H-indazole;5-tert-butyl-1H-indazole;6-tert-butyl-1H-indazole;4-(4-tert-butyl-2-methoxyphenyl)-1H-pyrazole;5-tert-butyl-3-methyl-2H-indazole;5-tert-butyl-4-methyl-1H-indazole;4-(3-tert-butylphenyl)-1H-pyrazole;4-(4-tert-butylphenyl)-1H-pyrazole;2-tert-butyl-5-(1H-pyrazol-4-yl)pyridine;5-tert-butyl-2-(1H-pyrazol-4-yl)pyridine is sourced from PubChem (CID 160893202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).