[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone

C85H120Cl4N14O8 — CID 158304663

IUPAC[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone
SMILESCC(C)(C1CCN(C(=O)C2CCCCC2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC1(C(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)CC1.CN(C)CC(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CN(C)CCC(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1
InChIInChI=1S/C23H32ClN3O2.C21H31ClN4O2.C21H28ClN3O2.C20H29ClN4O2/c1-23(2,21(28)19-13-18(24)12-16-14-25-26-20(16)19)17-8-10-27(11-9-17)22(29)15-6-4-3-5-7-15;1-21(2,15-5-9-26(10-6-15)18(27)7-8-25(3)4)20(28)17-12-16(22)11-14-13-23-24-19(14)17;1-20(2,14-4-8-25(9-5-14)19(27)21(3)6-7-21)18(26)16-11-15(22)10-13-12-23-24-17(13)16;1-20(2,14-5-7-25(8-6-14)17(26)12-24(3)4)19(27)16-10-15(21)9-13-11-22-23-18(13)16/h12-15,17,21,28H,3-11H2,1-2H3,(H,25,26);11-13,15,20,28H,5-10H2,1-4H3,(H,23,24);10-12,14,18,26H,4-9H2,1-3H3,(H,23,24);9-11,14,19,27H,5-8,12H2,1-4H3,(H,22,23)
InChIKeyGMXVJJPLLSXSEP-UHFFFAOYSA-N
MW1607.80 g/mol
LogP15.95
Rot. Bonds19

About [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone

[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone (PubChem CID 158304663) has the molecular formula C85H120Cl4N14O8 and a molecular weight of 1607.80 g/mol. Its IUPAC name is [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone.

Molecular Properties

Compound Name[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone
PubChem CID158304663
Molecular FormulaC85H120Cl4N14O8
Molecular Weight1607.80 g/mol
Exact Mass1604.82
IUPAC Name[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone
SMILESCC(C)(C1CCN(C(=O)C2CCCCC2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC1(C(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)CC1.CN(C)CC(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CN(C)CCC(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1
InChIInChI=1S/C23H32ClN3O2.C21H31ClN4O2.C21H28ClN3O2.C20H29ClN4O2/c1-23(2,21(28)19-13-18(24)12-16-14-25-26-20(16)19)17-8-10-27(11-9-17)22(29)15-6-4-3-5-7-15;1-21(2,15-5-9-26(10-6-15)18(27)7-8-25(3)4)20(28)17-12-16(22)11-14-13-23-24-19(14)17;1-20(2,14-4-8-25(9-5-14)19(27)21(3)6-7-21)18(26)16-11-15(22)10-13-12-23-24-17(13)16;1-20(2,14-5-7-25(8-6-14)17(26)12-24(3)4)19(27)16-10-15(21)9-13-11-22-23-18(13)16/h12-15,17,21,28H,3-11H2,1-2H3,(H,25,26);11-13,15,20,28H,5-10H2,1-4H3,(H,23,24);10-12,14,18,26H,4-9H2,1-3H3,(H,23,24);9-11,14,19,27H,5-8,12H2,1-4H3,(H,22,23)
InChIKeyGMXVJJPLLSXSEP-UHFFFAOYSA-N
XLogP15.95
TPSA283.36 Ų
H-Bond Donors8
H-Bond Acceptors14
Rotatable Bonds19
Heavy Atoms111
Complexity

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001607.80
LogP ≤ 515.95
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1014

Analyze [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Frequently Asked Questions

What is the IUPAC name of [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone?
The IUPAC name of [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone (CID 158304663) is [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone.
What is the SMILES notation for [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone?
The canonical SMILES for [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone is CC(C)(C1CCN(C(=O)C2CCCCC2)CC1)C(O)c1cc(Cl)cc2cn[nH]c12.CC1(C(=O)N2CCC(C(C)(C)C(O)c3cc(Cl)cc4cn[nH]c34)CC2)CC1.CN(C)CC(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.CN(C)CCC(=O)N1CCC(C(C)(C)C(O)c2cc(Cl)cc3cn[nH]c23)CC1.
What is the InChIKey of [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone?
The InChIKey is GMXVJJPLLSXSEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H32ClN3O2.C21H31ClN4O2.C21H28ClN3O2.C20H29ClN4O2/c1-23(2,21(28)19-13-18(24)12-16-14-25-26-20(16)19)17-8-10-27(11-9-17)22(29)15-6-4-3-5-7-15;1-21(2,15-5-9-26(10-6-15)18(27)7-8-25(3)4)20(28)17-12-16(22)11-14-13-23-24-19(14)17;1-20(2,14-4-8-25(9-5-14)19(27)21(3)6-7-21)18(26)16-11-15(22)10-13-12-23-24-17(13)16;1-20(2,14-5-7-25(8-6-14)17(26)12-24(3)4)19(27)16-10-15(21)9-13-11-22-23-18(13)16/h12-15,17,21,28H,3-11H2,1-2H3,(H,25,26);11-13,15,20,28H,5-10H2,1-4H3,(H,23,24);10-12,14,18,26H,4-9H2,1-3H3,(H,23,24);9-11,14,19,27H,5-8,12H2,1-4H3,(H,22,23).
What are the key properties of [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone?
[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone has a molecular weight of 1607.80 g/mol, XLogP of 15.95, 19 rotatable bonds, 8 hydrogen bond donors, and 14 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-cyclohexylmethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-2-(dimethylamino)ethanone;1-[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-3-(dimethylamino)propan-1-one;[4-[1-(5-chloro-1H-indazol-7-yl)-1-hydroxy-2-methylpropan-2-yl]piperidin-1-yl]-(1-methylcyclopropyl)methanone is sourced from PubChem (CID 158304663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).