1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene

C17H29NO — CID 143603790

IUPAC1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene
SMILESCC1CC(C)(C)N(O)C(C)(C)C1.Cc1ccccc1
InChIInChI=1S/C10H21NO.C7H8/c1-8-6-9(2,3)11(12)10(4,5)7-8;1-7-5-3-2-4-6-7/h8,12H,6-7H2,1-5H3;2-6H,1H3
InChIKeyPRSGDVPOXAZUTM-UHFFFAOYSA-N
MW263.43 g/mol
LogP4.66
Rot. Bonds

About 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene

1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene (PubChem CID 143603790) has the molecular formula C17H29NO and a molecular weight of 263.43 g/mol. Its IUPAC name is 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene.

Molecular Properties

Compound Name1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene
PubChem CID143603790
Molecular FormulaC17H29NO
Molecular Weight263.43 g/mol
Exact Mass263.22
IUPAC Name1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene
SMILESCC1CC(C)(C)N(O)C(C)(C)C1.Cc1ccccc1
InChIInChI=1S/C10H21NO.C7H8/c1-8-6-9(2,3)11(12)10(4,5)7-8;1-7-5-3-2-4-6-7/h8,12H,6-7H2,1-5H3;2-6H,1H3
InChIKeyPRSGDVPOXAZUTM-UHFFFAOYSA-N
XLogP4.66
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene?
The IUPAC name of 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene (CID 143603790) is 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene.
What is the SMILES notation for 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene?
The canonical SMILES for 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene is CC1CC(C)(C)N(O)C(C)(C)C1.Cc1ccccc1.
What is the InChIKey of 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene?
The InChIKey is PRSGDVPOXAZUTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.C7H8/c1-8-6-9(2,3)11(12)10(4,5)7-8;1-7-5-3-2-4-6-7/h8,12H,6-7H2,1-5H3;2-6H,1H3.
What are the key properties of 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene?
1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene has a molecular weight of 263.43 g/mol, XLogP of 4.66, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2,2,4,6,6-pentamethylpiperidine;toluene is sourced from PubChem (CID 143603790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).