1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol

C32H66N4O4 — CID 22507683

IUPAC1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol
SMILESCC(C)(O)CON1C(C)(C)CC(NCCCCCCNC2CC(C)(C)N(OCC(C)(C)O)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C32H66N4O4/c1-27(2)19-25(20-28(3,4)35(27)39-23-31(9,10)37)33-17-15-13-14-16-18-34-26-21-29(5,6)36(30(7,8)22-26)40-24-32(11,12)38/h25-26,33-34,37-38H,13-24H2,1-12H3
InChIKeyMPTQRPVRFOLXPM-UHFFFAOYSA-N
MW570.90 g/mol
LogP5.17
Rot. Bonds15

About 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol

1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol (PubChem CID 22507683) has the molecular formula C32H66N4O4 and a molecular weight of 570.90 g/mol. Its IUPAC name is 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol.

Molecular Properties

Compound Name1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol
PubChem CID22507683
Molecular FormulaC32H66N4O4
Molecular Weight570.90 g/mol
Exact Mass570.51
IUPAC Name1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol
SMILESCC(C)(O)CON1C(C)(C)CC(NCCCCCCNC2CC(C)(C)N(OCC(C)(C)O)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C32H66N4O4/c1-27(2)19-25(20-28(3,4)35(27)39-23-31(9,10)37)33-17-15-13-14-16-18-34-26-21-29(5,6)36(30(7,8)22-26)40-24-32(11,12)38/h25-26,33-34,37-38H,13-24H2,1-12H3
InChIKeyMPTQRPVRFOLXPM-UHFFFAOYSA-N
XLogP5.17
TPSA89.46 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds15
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500570.90
LogP ≤ 55.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol?
The IUPAC name of 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol (CID 22507683) is 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol.
What is the SMILES notation for 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol?
The canonical SMILES for 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol is CC(C)(O)CON1C(C)(C)CC(NCCCCCCNC2CC(C)(C)N(OCC(C)(C)O)C(C)(C)C2)CC1(C)C.
What is the InChIKey of 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol?
The InChIKey is MPTQRPVRFOLXPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H66N4O4/c1-27(2)19-25(20-28(3,4)35(27)39-23-31(9,10)37)33-17-15-13-14-16-18-34-26-21-29(5,6)36(30(7,8)22-26)40-24-32(11,12)38/h25-26,33-34,37-38H,13-24H2,1-12H3.
What are the key properties of 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol?
1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol has a molecular weight of 570.90 g/mol, XLogP of 5.17, 15 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-[6-[[1-(2-hydroxy-2-methylpropoxy)-2,2,6,6-tetramethylpiperidin-4-yl]amino]hexylamino]-2,2,6,6-tetramethylpiperidin-1-yl]oxy-2-methylpropan-2-ol is sourced from PubChem (CID 22507683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).