2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol

C18H37NO — CID 21330439

IUPAC2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol
SMILESCC(C)CC1(C)CC(O)C(C(C)C)C(C)(CC(C)C)N1
InChIInChI=1S/C18H37NO/c1-12(2)9-17(7)11-15(20)16(14(5)6)18(8,19-17)10-13(3)4/h12-16,19-20H,9-11H2,1-8H3
InChIKeyYKCPRUFZNQMGOP-UHFFFAOYSA-N
MW283.50 g/mol
LogP4.22
Rot. Bonds5

About 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol

2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol (PubChem CID 21330439) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol.

Molecular Properties

Compound Name2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol
PubChem CID21330439
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Name2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol
SMILESCC(C)CC1(C)CC(O)C(C(C)C)C(C)(CC(C)C)N1
InChIInChI=1S/C18H37NO/c1-12(2)9-17(7)11-15(20)16(14(5)6)18(8,19-17)10-13(3)4/h12-16,19-20H,9-11H2,1-8H3
InChIKeyYKCPRUFZNQMGOP-UHFFFAOYSA-N
XLogP4.22
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.50
LogP ≤ 54.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-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 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol?
The IUPAC name of 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol (CID 21330439) is 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol.
What is the SMILES notation for 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol?
The canonical SMILES for 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol is CC(C)CC1(C)CC(O)C(C(C)C)C(C)(CC(C)C)N1.
What is the InChIKey of 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol?
The InChIKey is YKCPRUFZNQMGOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO/c1-12(2)9-17(7)11-15(20)16(14(5)6)18(8,19-17)10-13(3)4/h12-16,19-20H,9-11H2,1-8H3.
What are the key properties of 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol?
2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol has a molecular weight of 283.50 g/mol, XLogP of 4.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-2,6-bis(2-methylpropyl)-3-propan-2-ylpiperidin-4-ol is sourced from PubChem (CID 21330439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).