4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine

C20H41NO — CID 23557636

IUPAC4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine
SMILESCCCCCCCC(C)CN1C(C)(C)CC(OC)CC1(C)C
InChIInChI=1S/C20H41NO/c1-8-9-10-11-12-13-17(2)16-21-19(3,4)14-18(22-7)15-20(21,5)6/h17-18H,8-16H2,1-7H3
InChIKeyPOVZPMUWVXIEES-UHFFFAOYSA-N
MW311.55 g/mol
LogP5.65
Rot. Bonds9

About 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine

4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine (PubChem CID 23557636) has the molecular formula C20H41NO and a molecular weight of 311.55 g/mol. Its IUPAC name is 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine.

Molecular Properties

Compound Name4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine
PubChem CID23557636
Molecular FormulaC20H41NO
Molecular Weight311.55 g/mol
Exact Mass311.32
IUPAC Name4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine
SMILESCCCCCCCC(C)CN1C(C)(C)CC(OC)CC1(C)C
InChIInChI=1S/C20H41NO/c1-8-9-10-11-12-13-17(2)16-21-19(3,4)14-18(22-7)15-20(21,5)6/h17-18H,8-16H2,1-7H3
InChIKeyPOVZPMUWVXIEES-UHFFFAOYSA-N
XLogP5.65
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500311.55
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Pemerid
CID 3039330
2-Butyl-2-cyclopropyl-3,4,4,6-tetramethyl-1,3-oxazinane
CID 86068112
4-Ethoxy-1,2,2,6,6-pentamethylpiperidine
CID 18714091
4-Methoxy-2,2,6,6-tetramethyl-1-(2-methylpropyl)piperidine
CID 18715871
Sodium 1,2,2,6,6-pentamethylpiperidin-4-olate
CID 18723743
4-Ethenoxy-1,2,2,6,6-pentaethylpiperidine
CID 19101888
N-[diethylamino-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxyphosphanyl]-N-ethylethanamine
CID 19609101
1,2,2,6,6-Pentamethyl-4-(1,2,2,6,6-pentamethylpiperidin-4-yl)oxypiperidine
CID 20492240
4-Dodecoxy-1,2,2,6,6-pentamethylpiperidine
CID 20492244
3-(4-Methoxy-2,2,6,6-tetramethylpiperidin-1-yl)-2-methylpropanenitrile
CID 20492371
4-Dodecoxy-2,2,6,6-tetramethyl-1-propylpiperidine
CID 20492454
4-Methoxy-1,2,2,6,6-pentamethylpiperidine
CID 20492460

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine?
The IUPAC name of 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine (CID 23557636) is 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine.
What is the SMILES notation for 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine?
The canonical SMILES for 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine is CCCCCCCC(C)CN1C(C)(C)CC(OC)CC1(C)C.
What is the InChIKey of 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine?
The InChIKey is POVZPMUWVXIEES-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41NO/c1-8-9-10-11-12-13-17(2)16-21-19(3,4)14-18(22-7)15-20(21,5)6/h17-18H,8-16H2,1-7H3.
What are the key properties of 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine?
4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine has a molecular weight of 311.55 g/mol, XLogP of 5.65, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2,2,6,6-tetramethyl-1-(2-methylnonyl)piperidine is sourced from PubChem (CID 23557636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).