N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide

C30H60N4O2 — CID 22966887

IUPACN-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide
SMILESCOCN(CCCCCCN(C(C)=O)C1CC(C)(C)N(C)C(C)(C)C1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C30H60N4O2/c1-24(35)34(26-21-29(6,7)32(11)30(8,9)22-26)18-16-14-13-15-17-33(23-36-12)25-19-27(2,3)31(10)28(4,5)20-25/h25-26H,13-23H2,1-12H3
InChIKeyACGMNUAZUFLODC-UHFFFAOYSA-N
MW508.84 g/mol
LogP5.60
Rot. Bonds11

About N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide

N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide (PubChem CID 22966887) has the molecular formula C30H60N4O2 and a molecular weight of 508.84 g/mol. Its IUPAC name is N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide.

Molecular Properties

Compound NameN-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide
PubChem CID22966887
Molecular FormulaC30H60N4O2
Molecular Weight508.84 g/mol
Exact Mass508.47
IUPAC NameN-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide
SMILESCOCN(CCCCCCN(C(C)=O)C1CC(C)(C)N(C)C(C)(C)C1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C30H60N4O2/c1-24(35)34(26-21-29(6,7)32(11)30(8,9)22-26)18-16-14-13-15-17-33(23-36-12)25-19-27(2,3)31(10)28(4,5)20-25/h25-26H,13-23H2,1-12H3
InChIKeyACGMNUAZUFLODC-UHFFFAOYSA-N
XLogP5.60
TPSA39.26 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds11
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500508.84
LogP ≤ 55.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide?
The IUPAC name of N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide (CID 22966887) is N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide.
What is the SMILES notation for N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide?
The canonical SMILES for N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide is COCN(CCCCCCN(C(C)=O)C1CC(C)(C)N(C)C(C)(C)C1)C1CC(C)(C)N(C)C(C)(C)C1.
What is the InChIKey of N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide?
The InChIKey is ACGMNUAZUFLODC-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H60N4O2/c1-24(35)34(26-21-29(6,7)32(11)30(8,9)22-26)18-16-14-13-15-17-33(23-36-12)25-19-27(2,3)31(10)28(4,5)20-25/h25-26H,13-23H2,1-12H3.
What are the key properties of N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide?
N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide has a molecular weight of 508.84 g/mol, XLogP of 5.60, 11 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[methoxymethyl-(1,2,2,6,6-pentamethylpiperidin-4-yl)amino]hexyl]-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)acetamide is sourced from PubChem (CID 22966887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).