2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane

C122H187F6N19O — CID 158551318

IUPAC2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane
SMILESCC(C)(C)N1CCC2(CCC(O)(c3ccncc3)CC2)C1.CC(C)(C)N1CCC2(CCCN(c3ccncc3)C2)C1.CC(C)(C)N1CCC2(CCN(c3ccc(C(F)(F)F)cc3)CC2)C1.CC(C)(C)N1CCC2(CCN(c3ccnc(C(F)(F)F)c3)CC2)C1.CC(C)(C)N1CCC2(CCN(c3ccncc3)C2)C1.CC(C)(C)N1CCC2(CCN(c3ccncc3)C2)CC1.CC(C)(C)N1CCCC2(CCN(c3ccncc3)C2)C1
InChIInChI=1S/C19H27F3N2.C18H26F3N3.C18H28N2O.3C17H27N3.C16H25N3/c1-17(2,3)24-13-10-18(14-24)8-11-23(12-9-18)16-6-4-15(5-7-16)19(20,21)22;1-16(2,3)24-11-7-17(13-24)5-9-23(10-6-17)14-4-8-22-15(12-14)18(19,20)21;1-16(2,3)20-13-10-17(14-20)6-8-18(21,9-7-17)15-4-11-19-12-5-15;1-16(2,3)20-12-7-17(8-13-20)6-11-19(14-17)15-4-9-18-10-5-15;1-16(2,3)20-11-4-7-17(14-20)8-12-19(13-17)15-5-9-18-10-6-15;1-16(2,3)20-12-8-17(14-20)7-4-11-19(13-17)15-5-9-18-10-6-15;1-15(2,3)19-11-7-16(13-19)6-10-18(12-16)14-4-8-17-9-5-14/h4-7H,8-14H2,1-3H3;4,8,12H,5-7,9-11,13H2,1-3H3;4-5,11-12,21H,6-10,13-14H2,1-3H3;4-5,9-10H,6-8,11-14H2,1-3H3;2*5-6,9-10H,4,7-8,11-14H2,1-3H3;4-5,8-9H,6-7,10-13H2,1-3H3
InChIKeyHPTJTZXRQCRANK-UHFFFAOYSA-N
MW2049.96 g/mol
LogP24.62
Rot. Bonds7

About 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane

2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane (PubChem CID 158551318) has the molecular formula C122H187F6N19O and a molecular weight of 2049.96 g/mol. Its IUPAC name is 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane
PubChem CID158551318
Molecular FormulaC122H187F6N19O
Molecular Weight2049.96 g/mol
Exact Mass2048.51
IUPAC Name2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane
SMILESCC(C)(C)N1CCC2(CCC(O)(c3ccncc3)CC2)C1.CC(C)(C)N1CCC2(CCCN(c3ccncc3)C2)C1.CC(C)(C)N1CCC2(CCN(c3ccc(C(F)(F)F)cc3)CC2)C1.CC(C)(C)N1CCC2(CCN(c3ccnc(C(F)(F)F)c3)CC2)C1.CC(C)(C)N1CCC2(CCN(c3ccncc3)C2)C1.CC(C)(C)N1CCC2(CCN(c3ccncc3)C2)CC1.CC(C)(C)N1CCCC2(CCN(c3ccncc3)C2)C1
InChIInChI=1S/C19H27F3N2.C18H26F3N3.C18H28N2O.3C17H27N3.C16H25N3/c1-17(2,3)24-13-10-18(14-24)8-11-23(12-9-18)16-6-4-15(5-7-16)19(20,21)22;1-16(2,3)24-11-7-17(13-24)5-9-23(10-6-17)14-4-8-22-15(12-14)18(19,20)21;1-16(2,3)20-13-10-17(14-20)6-8-18(21,9-7-17)15-4-11-19-12-5-15;1-16(2,3)20-12-7-17(8-13-20)6-11-19(14-17)15-4-9-18-10-5-15;1-16(2,3)20-11-4-7-17(14-20)8-12-19(13-17)15-5-9-18-10-6-15;1-16(2,3)20-12-8-17(14-20)7-4-11-19(13-17)15-5-9-18-10-6-15;1-15(2,3)19-11-7-16(13-19)6-10-18(12-16)14-4-8-17-9-5-14/h4-7H,8-14H2,1-3H3;4,8,12H,5-7,9-11,13H2,1-3H3;4-5,11-12,21H,6-10,13-14H2,1-3H3;4-5,9-10H,6-8,11-14H2,1-3H3;2*5-6,9-10H,4,7-8,11-14H2,1-3H3;4-5,8-9H,6-7,10-13H2,1-3H3
InChIKeyHPTJTZXRQCRANK-UHFFFAOYSA-N
XLogP24.62
TPSA139.69 Ų
H-Bond Donors1
H-Bond Acceptors20
Rotatable Bonds7
Heavy Atoms148
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002049.96
LogP ≤ 524.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1020

Analyze 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane (CID 158551318) is 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane is CC(C)(C)N1CCC2(CCC(O)(c3ccncc3)CC2)C1.CC(C)(C)N1CCC2(CCCN(c3ccncc3)C2)C1.CC(C)(C)N1CCC2(CCN(c3ccc(C(F)(F)F)cc3)CC2)C1.CC(C)(C)N1CCC2(CCN(c3ccnc(C(F)(F)F)c3)CC2)C1.CC(C)(C)N1CCC2(CCN(c3ccncc3)C2)C1.CC(C)(C)N1CCC2(CCN(c3ccncc3)C2)CC1.CC(C)(C)N1CCCC2(CCN(c3ccncc3)C2)C1.
What is the InChIKey of 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane?
The InChIKey is HPTJTZXRQCRANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27F3N2.C18H26F3N3.C18H28N2O.3C17H27N3.C16H25N3/c1-17(2,3)24-13-10-18(14-24)8-11-23(12-9-18)16-6-4-15(5-7-16)19(20,21)22;1-16(2,3)24-11-7-17(13-24)5-9-23(10-6-17)14-4-8-22-15(12-14)18(19,20)21;1-16(2,3)20-13-10-17(14-20)6-8-18(21,9-7-17)15-4-11-19-12-5-15;1-16(2,3)20-12-7-17(8-13-20)6-11-19(14-17)15-4-9-18-10-5-15;1-16(2,3)20-11-4-7-17(14-20)8-12-19(13-17)15-5-9-18-10-6-15;1-16(2,3)20-12-8-17(14-20)7-4-11-19(13-17)15-5-9-18-10-6-15;1-15(2,3)19-11-7-16(13-19)6-10-18(12-16)14-4-8-17-9-5-14/h4-7H,8-14H2,1-3H3;4,8,12H,5-7,9-11,13H2,1-3H3;4-5,11-12,21H,6-10,13-14H2,1-3H3;4-5,9-10H,6-8,11-14H2,1-3H3;2*5-6,9-10H,4,7-8,11-14H2,1-3H3;4-5,8-9H,6-7,10-13H2,1-3H3.
What are the key properties of 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane?
2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane has a molecular weight of 2049.96 g/mol, XLogP of 24.62, 7 rotatable bonds, 1 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-8-pyridin-4-yl-2-azaspiro[4.5]decan-8-ol;2-tert-butyl-9-pyridin-4-yl-2,9-diazaspiro[4.5]decane;7-tert-butyl-2-pyridin-4-yl-2,7-diazaspiro[4.5]decane;8-tert-butyl-2-pyridin-4-yl-2,8-diazaspiro[4.5]decane;2-tert-butyl-7-pyridin-4-yl-2,7-diazaspiro[4.4]nonane;2-tert-butyl-8-[4-(trifluoromethyl)phenyl]-2,8-diazaspiro[4.5]decane;2-tert-butyl-8-[2-(trifluoromethyl)-4-pyridinyl]-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 158551318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).