1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol

C76H94Cl2F4N10O5 — CID 158405157

IUPAC1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol
SMILESCC1(C(O)c2cc(C(F)(F)F)cc3cn[nH]c23)CCCCC1.CC1(F)CCC(O)(c2cc(Cl)cc3cn[nH]c23)CC1.Cc1cc(C(O)C2(C)CCCCC2)c2[nH]ncc2c1.Cc1ccc2cn[nH]c2c1C(O)C1(C)CCCCC1.OC1(c2cc(Cl)cc3cn[nH]c23)CC2(CCC2)C1
InChIInChI=1S/C16H19F3N2O.2C16H22N2O.C14H16ClFN2O.C14H15ClN2O/c1-15(5-3-2-4-6-15)14(22)12-8-11(16(17,18)19)7-10-9-20-21-13(10)12;1-11-6-7-12-10-17-18-14(12)13(11)15(19)16(2)8-4-3-5-9-16;1-11-8-12-10-17-18-14(12)13(9-11)15(19)16(2)6-4-3-5-7-16;1-13(16)2-4-14(19,5-3-13)11-7-10(15)6-9-8-17-18-12(9)11;15-10-4-9-6-16-17-12(9)11(5-10)14(18)7-13(8-14)2-1-3-13/h7-9,14,22H,2-6H2,1H3,(H,20,21);6-7,10,15,19H,3-5,8-9H2,1-2H3,(H,17,18);8-10,15,19H,3-7H2,1-2H3,(H,17,18);6-8,19H,2-5H2,1H3,(H,17,18);4-6,18H,1-3,7-8H2,(H,16,17)
InChIKeyGYPDIKJKLDGHBO-UHFFFAOYSA-N
MW1374.55 g/mol
LogP19.41
Rot. Bonds8

About 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol

1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol (PubChem CID 158405157) has the molecular formula C76H94Cl2F4N10O5 and a molecular weight of 1374.55 g/mol. Its IUPAC name is 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol.

Molecular Properties

Compound Name1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol
PubChem CID158405157
Molecular FormulaC76H94Cl2F4N10O5
Molecular Weight1374.55 g/mol
Exact Mass1372.67
IUPAC Name1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol
SMILESCC1(C(O)c2cc(C(F)(F)F)cc3cn[nH]c23)CCCCC1.CC1(F)CCC(O)(c2cc(Cl)cc3cn[nH]c23)CC1.Cc1cc(C(O)C2(C)CCCCC2)c2[nH]ncc2c1.Cc1ccc2cn[nH]c2c1C(O)C1(C)CCCCC1.OC1(c2cc(Cl)cc3cn[nH]c23)CC2(CCC2)C1
InChIInChI=1S/C16H19F3N2O.2C16H22N2O.C14H16ClFN2O.C14H15ClN2O/c1-15(5-3-2-4-6-15)14(22)12-8-11(16(17,18)19)7-10-9-20-21-13(10)12;1-11-6-7-12-10-17-18-14(12)13(11)15(19)16(2)8-4-3-5-9-16;1-11-8-12-10-17-18-14(12)13(9-11)15(19)16(2)6-4-3-5-7-16;1-13(16)2-4-14(19,5-3-13)11-7-10(15)6-9-8-17-18-12(9)11;15-10-4-9-6-16-17-12(9)11(5-10)14(18)7-13(8-14)2-1-3-13/h7-9,14,22H,2-6H2,1H3,(H,20,21);6-7,10,15,19H,3-5,8-9H2,1-2H3,(H,17,18);8-10,15,19H,3-7H2,1-2H3,(H,17,18);6-8,19H,2-5H2,1H3,(H,17,18);4-6,18H,1-3,7-8H2,(H,16,17)
InChIKeyGYPDIKJKLDGHBO-UHFFFAOYSA-N
XLogP19.41
TPSA244.55 Ų
H-Bond Donors10
H-Bond Acceptors10
Rotatable Bonds8
Heavy Atoms97
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001374.55
LogP ≤ 519.41
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1010

Analyze 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol with MolForge

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Related Compounds

(5-chloro-1H-indazol-7-yl)-cyclobutylmethanol;1-(5-chloro-1H-indazol-7-yl)-2-cyclobutyl-2-methylpropan-1-ol;(5-chloro-1H-indazol-7-yl)-[1-(1,1-difluoroethyl)cyclobutyl]methanol;(5-chloro-1H-indazol-7-yl)-[1-(1,1-difluoroethyl)cyclopropyl]methanol;(5-chloro-1H-indazol-7-yl)-(1-methylcyclobutyl)methanol
CID 157654099
tert-butyl 2-(5-chloro-1H-indazol-7-yl)-2-hydroxy-7-azaspiro[3.5]nonane-7-carboxylate;2-(5-chloro-1H-indazol-7-yl)-7-azaspiro[3.5]nonan-2-ol;1-(5-chloro-1H-indazol-7-yl)-4,4-difluorocyclohexan-1-ol;(5-chloro-1H-indazol-7-yl)-(3,3-difluoro-1-methylcyclobutyl)methanol;(5-chloro-1H-indazol-7-yl)-(1-methylcyclopentyl)methanol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;5-(5-chloro-1H-indazol-7-yl)spiro[2.3]hexan-5-ol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol
CID 158103345
(5-chloro-1H-indazol-7-yl)-(1-cyclopropylcyclopropyl)methanol;1-(5-chloro-1H-indazol-7-yl)-2-cyclopropyl-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-3-(1,1-difluoroethyl)-3-(2-fluoropropan-2-yl)cyclobutan-1-ol;(5-chloro-1H-indazol-7-yl)-(1-ethylcyclobutyl)methanol;(5-chloro-1H-indazol-7-yl)-(4-methyl-1-bicyclo[2.2.2]octanyl)methanol;(5-chloro-1H-indazol-7-yl)-[1-(methyl-methylidene-oxo-lambda6-sulfanyl)azetidin-3-yl]methanol
CID 158792390
1-(5-chloro-1H-indazol-7-yl)-2-cyclohexyl-2,2-difluoroethanol;1-(5-chloro-1H-indazol-7-yl)-2-cyclohexyl-2-methylpropan-1-ol;(1S,5S)-1'-(5-chloro-1H-indazol-7-yl)-6,6-dimethylspiro[bicyclo[3.1.1]heptane-2,3'-cyclobutane]-1'-ol;1'-(5-chloro-1H-indazol-7-yl)-2,2-dimethylspiro[bicyclo[2.2.1]heptane-3,3'-cyclobutane]-1'-ol;(5-chloro-1H-indazol-7-yl)-[1-[(3-methylphenyl)methyl]cyclobutyl]methanol;3-(6-chloro-3H-inden-4-yl)-1,1-dioxothietan-3-ol
CID 159903261
(6-chloro-5-fluoro-3H-isoindol-4-yl)-(1-methylcyclohexyl)methanol;2-(5-chloro-1H-indazol-7-yl)spiro[3.5]nonan-2-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.4]octan-2-ol;[1-(1,1-difluoroethyl)cyclopentyl]-(6-methyl-1H-indazol-7-yl)methanol
CID 160080360
(5-chloro-4,6-difluoro-1H-indazol-7-yl)-cyclobutylmethanol;1-(5-chloro-4,6-difluoro-1H-indazol-7-yl)-2-cyclobutyl-2-methylpropan-1-ol;(5-chloro-4,6-difluoro-1H-indazol-7-yl)-(1-cyclohexylcyclopropyl)methanol;1-(5-chloro-4,6-difluoro-1H-indazol-7-yl)-2,2-dimethylpropan-1-ol;1'-(5-chloro-4,6-difluoro-1H-indazol-7-yl)spiro[bicyclo[3.3.1]nonane-9,3'-cyclobutane]-1'-ol;1-(5-chloro-1H-indazol-7-yl)-3,3-difluoro-2,2-dimethylbutan-1-ol
CID 161891907
1-adamantyl-(5-chloro-1H-indazol-7-yl)methanol;1-(5-chloro-1H-indazol-7-yl)-2-cyclohexylethanol;1-(5-chloro-1H-indazol-7-yl)-2-cyclohexyl-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-3-cyclohexylpropan-1-ol;5-chloro-7-[1-(1-methylcyclohexyl)ethyl]-1H-indazole
CID 157510505
1-adamantyl-(6-methyl-1H-indazol-7-yl)methanol;1-(5-chloro-1H-indazol-7-yl)-3-[(methyl-methylidene-oxo-lambda6-sulfanyl)methyl]cyclobutan-1-ol;bis(2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol);(5-fluoro-1H-indazol-7-yl)-(1-methylcyclohexyl)methanol
CID 158086349
1-bicyclo[2.2.2]octanyl-(5-chloro-1H-indazol-7-yl)methanol;7-[1-(1-bicyclo[1.1.1]pentanyl)ethyl]-5-chloro-1H-indazole;1-(5-chloro-1H-indazol-7-yl)cyclobutan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-cyclohexylethanol;(6-chloro-1H-indazol-7-yl)-(1-methylcyclohexyl)methanol
CID 158198555
1-adamantyl-(5-chloro-6-fluoro-1H-indazol-7-yl)methanol;1-(5-chloro-4,6-difluoro-1H-indazol-7-yl)-2-cyclohexyl-2-methylpropan-1-ol;1-(5-chloro-4,6-difluoro-1H-indazol-7-yl)-2-cyclopentyl-2-methylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-3-cyclohexyl-2,2-dimethylpropan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2,2-diethylhex-5-yn-1-ol;1-(5-chloro-1H-indazol-7-yl)-2-ethyl-2-methylbutan-1-ol
CID 159042313
(5-chloro-1H-indazol-7-yl)-(4-ethylcyclohexyl)methanol;(5-chloro-1H-indazol-7-yl)-[1-(1-fluoroethyl)cyclobutyl]methanol;1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-(1-methylsulfonylpiperidin-4-yl)propan-1-ol;(5-chloro-1H-indazol-7-yl)-spiro[3.3]heptan-2-ylmethanol;(6-chloro-3H-isoindol-4-yl)-(3,3-dimethylcyclobutyl)methanol
CID 159781549
3-tert-butyl-1-(5-chloro-1H-indazol-7-yl)cyclobutan-1-ol;1-(5-chloro-1H-indazol-7-yl)-2,2-dimethylpropan-1-ol;5-(5-chloro-1H-indazol-7-yl)-5-hydroxy-4,4-dimethylpentanenitrile;(5-chloro-1H-indazol-7-yl)-(1-methylcyclobutyl)methanol;bis(1-(5-chloro-1H-indazol-7-yl)-2-methyl-2-piperidin-1-ylpropan-1-ol)
CID 160721859

Frequently Asked Questions

What is the IUPAC name of 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol?
The IUPAC name of 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol (CID 158405157) is 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol.
What is the SMILES notation for 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol?
The canonical SMILES for 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol is CC1(C(O)c2cc(C(F)(F)F)cc3cn[nH]c23)CCCCC1.CC1(F)CCC(O)(c2cc(Cl)cc3cn[nH]c23)CC1.Cc1cc(C(O)C2(C)CCCCC2)c2[nH]ncc2c1.Cc1ccc2cn[nH]c2c1C(O)C1(C)CCCCC1.OC1(c2cc(Cl)cc3cn[nH]c23)CC2(CCC2)C1.
What is the InChIKey of 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol?
The InChIKey is GYPDIKJKLDGHBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19F3N2O.2C16H22N2O.C14H16ClFN2O.C14H15ClN2O/c1-15(5-3-2-4-6-15)14(22)12-8-11(16(17,18)19)7-10-9-20-21-13(10)12;1-11-6-7-12-10-17-18-14(12)13(11)15(19)16(2)8-4-3-5-9-16;1-11-8-12-10-17-18-14(12)13(9-11)15(19)16(2)6-4-3-5-7-16;1-13(16)2-4-14(19,5-3-13)11-7-10(15)6-9-8-17-18-12(9)11;15-10-4-9-6-16-17-12(9)11(5-10)14(18)7-13(8-14)2-1-3-13/h7-9,14,22H,2-6H2,1H3,(H,20,21);6-7,10,15,19H,3-5,8-9H2,1-2H3,(H,17,18);8-10,15,19H,3-7H2,1-2H3,(H,17,18);6-8,19H,2-5H2,1H3,(H,17,18);4-6,18H,1-3,7-8H2,(H,16,17).
What are the key properties of 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol?
1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol has a molecular weight of 1374.55 g/mol, XLogP of 19.41, 8 rotatable bonds, 10 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chloro-1H-indazol-7-yl)-4-fluoro-4-methylcyclohexan-1-ol;2-(5-chloro-1H-indazol-7-yl)spiro[3.3]heptan-2-ol;(1-methylcyclohexyl)-(5-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-(6-methyl-1H-indazol-7-yl)methanol;(1-methylcyclohexyl)-[5-(trifluoromethyl)-1H-indazol-7-yl]methanol is sourced from PubChem (CID 158405157), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).