2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol

C24H48N2O3 — CID 18728801

IUPAC2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol
SMILESCC1CC(C)(C)N(OCC(C)(O)CON2C(C)(C)CC(C)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C24H48N2O3/c1-18-12-20(3,4)25(21(5,6)13-18)28-16-24(11,27)17-29-26-22(7,8)14-19(2)15-23(26,9)10/h18-19,27H,12-17H2,1-11H3
InChIKeyGFKDLPGWDPKUNU-UHFFFAOYSA-N
MW412.66 g/mol
LogP5.18
Rot. Bonds6

About 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol

2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol (PubChem CID 18728801) has the molecular formula C24H48N2O3 and a molecular weight of 412.66 g/mol. Its IUPAC name is 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol.

Molecular Properties

Compound Name2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol
PubChem CID18728801
Molecular FormulaC24H48N2O3
Molecular Weight412.66 g/mol
Exact Mass412.37
IUPAC Name2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol
SMILESCC1CC(C)(C)N(OCC(C)(O)CON2C(C)(C)CC(C)CC2(C)C)C(C)(C)C1
InChIInChI=1S/C24H48N2O3/c1-18-12-20(3,4)25(21(5,6)13-18)28-16-24(11,27)17-29-26-22(7,8)14-19(2)15-23(26,9)10/h18-19,27H,12-17H2,1-11H3
InChIKeyGFKDLPGWDPKUNU-UHFFFAOYSA-N
XLogP5.18
TPSA45.17 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500412.66
LogP ≤ 55.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol?
The IUPAC name of 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol (CID 18728801) is 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol.
What is the SMILES notation for 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol?
The canonical SMILES for 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol is CC1CC(C)(C)N(OCC(C)(O)CON2C(C)(C)CC(C)CC2(C)C)C(C)(C)C1.
What is the InChIKey of 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol?
The InChIKey is GFKDLPGWDPKUNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H48N2O3/c1-18-12-20(3,4)25(21(5,6)13-18)28-16-24(11,27)17-29-26-22(7,8)14-19(2)15-23(26,9)10/h18-19,27H,12-17H2,1-11H3.
What are the key properties of 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol?
2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol has a molecular weight of 412.66 g/mol, XLogP of 5.18, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1,3-bis[(2,2,4,6,6-pentamethylpiperidin-1-yl)oxy]propan-2-ol is sourced from PubChem (CID 18728801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).