bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)

C74H154N6O2 — CID 160528202

IUPACbis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)
SMILESCCCC1CC(C)(C)N(C)C(C)(C)C1.CCCC1CC(C)(C)N(C)C(C)(C)C1.CCCC1CC(C)(C)N(O)C(C)(C)C1.CCCC1CC(C)(C)N(O)C(C)(C)C1.CCCC1CC(C)(C)NC(C)(C)C1.CCCC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/2C13H27N.2C12H25NO.2C12H25N/c2*1-7-8-11-9-12(2,3)14(6)13(4,5)10-11;2*1-6-7-10-8-11(2,3)13(14)12(4,5)9-10;2*1-6-7-10-8-11(2,3)13-12(4,5)9-10/h2*11H,7-10H2,1-6H3;2*10,14H,6-9H2,1-5H3;2*10,13H,6-9H2,1-5H3
InChIKeyKAVAYRCVQUVJFU-UHFFFAOYSA-N
MW1160.09 g/mol
LogP20.95
Rot. Bonds12

About bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)

bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine) (PubChem CID 160528202) has the molecular formula C74H154N6O2 and a molecular weight of 1160.09 g/mol. Its IUPAC name is bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine).

Molecular Properties

Compound Namebis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)
PubChem CID160528202
Molecular FormulaC74H154N6O2
Molecular Weight1160.09 g/mol
Exact Mass1159.21
IUPAC Namebis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)
SMILESCCCC1CC(C)(C)N(C)C(C)(C)C1.CCCC1CC(C)(C)N(C)C(C)(C)C1.CCCC1CC(C)(C)N(O)C(C)(C)C1.CCCC1CC(C)(C)N(O)C(C)(C)C1.CCCC1CC(C)(C)NC(C)(C)C1.CCCC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/2C13H27N.2C12H25NO.2C12H25N/c2*1-7-8-11-9-12(2,3)14(6)13(4,5)10-11;2*1-6-7-10-8-11(2,3)13(14)12(4,5)9-10;2*1-6-7-10-8-11(2,3)13-12(4,5)9-10/h2*11H,7-10H2,1-6H3;2*10,14H,6-9H2,1-5H3;2*10,13H,6-9H2,1-5H3
InChIKeyKAVAYRCVQUVJFU-UHFFFAOYSA-N
XLogP20.95
TPSA77.48 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms82
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001160.09
LogP ≤ 520.95
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)?
The IUPAC name of bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine) (CID 160528202) is bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine).
What is the SMILES notation for bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)?
The canonical SMILES for bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine) is CCCC1CC(C)(C)N(C)C(C)(C)C1.CCCC1CC(C)(C)N(C)C(C)(C)C1.CCCC1CC(C)(C)N(O)C(C)(C)C1.CCCC1CC(C)(C)N(O)C(C)(C)C1.CCCC1CC(C)(C)NC(C)(C)C1.CCCC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)?
The InChIKey is KAVAYRCVQUVJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/2C13H27N.2C12H25NO.2C12H25N/c2*1-7-8-11-9-12(2,3)14(6)13(4,5)10-11;2*1-6-7-10-8-11(2,3)13(14)12(4,5)9-10;2*1-6-7-10-8-11(2,3)13-12(4,5)9-10/h2*11H,7-10H2,1-6H3;2*10,14H,6-9H2,1-5H3;2*10,13H,6-9H2,1-5H3.
What are the key properties of bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine)?
bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine) has a molecular weight of 1160.09 g/mol, XLogP of 20.95, 12 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-hydroxy-2,2,6,6-tetramethyl-4-propylpiperidine);bis(1,2,2,6,6-pentamethyl-4-propylpiperidine);bis(2,2,6,6-tetramethyl-4-propylpiperidine) is sourced from PubChem (CID 160528202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).