2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide

C29H58N4O — CID 11070846

IUPAC2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide
SMILESCC1(C)CC(NCCCCCCN(C(=O)C(C)(C)C)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C29H58N4O/c1-25(2,3)24(34)33(23-20-28(8,9)32-29(10,11)21-23)17-15-13-12-14-16-30-22-18-26(4,5)31-27(6,7)19-22/h22-23,30-32H,12-21H2,1-11H3
InChIKeyAJPOBPBABKDFFB-UHFFFAOYSA-N
MW478.81 g/mol
LogP5.63
Rot. Bonds9

About 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide

2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide (PubChem CID 11070846) has the molecular formula C29H58N4O and a molecular weight of 478.81 g/mol. Its IUPAC name is 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide
PubChem CID11070846
Molecular FormulaC29H58N4O
Molecular Weight478.81 g/mol
Exact Mass478.46
IUPAC Name2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide
SMILESCC1(C)CC(NCCCCCCN(C(=O)C(C)(C)C)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1
InChIInChI=1S/C29H58N4O/c1-25(2,3)24(34)33(23-20-28(8,9)32-29(10,11)21-23)17-15-13-12-14-16-30-22-18-26(4,5)31-27(6,7)19-22/h22-23,30-32H,12-21H2,1-11H3
InChIKeyAJPOBPBABKDFFB-UHFFFAOYSA-N
XLogP5.63
TPSA56.40 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500478.81
LogP ≤ 55.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide (CID 11070846) is 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide is CC1(C)CC(NCCCCCCN(C(=O)C(C)(C)C)C2CC(C)(C)NC(C)(C)C2)CC(C)(C)N1.
What is the InChIKey of 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide?
The InChIKey is AJPOBPBABKDFFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H58N4O/c1-25(2,3)24(34)33(23-20-28(8,9)32-29(10,11)21-23)17-15-13-12-14-16-30-22-18-26(4,5)31-27(6,7)19-22/h22-23,30-32H,12-21H2,1-11H3.
What are the key properties of 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide?
2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide has a molecular weight of 478.81 g/mol, XLogP of 5.63, 9 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-(2,2,6,6-tetramethylpiperidin-4-yl)-N-[6-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]hexyl]propanamide is sourced from PubChem (CID 11070846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).