N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide

C15H31N3O — CID 13446522

IUPACN-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide
SMILESCC(=O)NCCCCNC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C15H31N3O/c1-12(19)16-8-6-7-9-17-13-10-14(2,3)18-15(4,5)11-13/h13,17-18H,6-11H2,1-5H3,(H,16,19)
InChIKeyVFCHJTNJAADHRN-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.80
Rot. Bonds6

About N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide

N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide (PubChem CID 13446522) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide
PubChem CID13446522
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC NameN-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide
SMILESCC(=O)NCCCCNC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C15H31N3O/c1-12(19)16-8-6-7-9-17-13-10-14(2,3)18-15(4,5)11-13/h13,17-18H,6-11H2,1-5H3,(H,16,19)
InChIKeyVFCHJTNJAADHRN-UHFFFAOYSA-N
XLogP1.80
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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 N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide?
The IUPAC name of N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide (CID 13446522) is N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide.
What is the SMILES notation for N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide?
The canonical SMILES for N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide is CC(=O)NCCCCNC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide?
The InChIKey is VFCHJTNJAADHRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c1-12(19)16-8-6-7-9-17-13-10-14(2,3)18-15(4,5)11-13/h13,17-18H,6-11H2,1-5H3,(H,16,19).
What are the key properties of N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide?
N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide has a molecular weight of 269.43 g/mol, XLogP of 1.80, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]butyl]acetamide is sourced from PubChem (CID 13446522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).