2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide

C18H35N3O2 — CID 108521516

IUPAC2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide
SMILESCCCCN(CCC)C(=O)C(=O)N1C(C)(C)CC(N)CC1(C)C
InChIInChI=1S/C18H35N3O2/c1-7-9-11-20(10-8-2)15(22)16(23)21-17(3,4)12-14(19)13-18(21,5)6/h14H,7-13,19H2,1-6H3
InChIKeyVPJVMDSQKSBCEL-UHFFFAOYSA-N
MW325.50 g/mol
LogP2.53
Rot. Bonds5

About 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide

2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide (PubChem CID 108521516) has the molecular formula C18H35N3O2 and a molecular weight of 325.50 g/mol. Its IUPAC name is 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide.

Molecular Properties

Compound Name2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide
PubChem CID108521516
Molecular FormulaC18H35N3O2
Molecular Weight325.50 g/mol
Exact Mass325.27
IUPAC Name2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide
SMILESCCCCN(CCC)C(=O)C(=O)N1C(C)(C)CC(N)CC1(C)C
InChIInChI=1S/C18H35N3O2/c1-7-9-11-20(10-8-2)15(22)16(23)21-17(3,4)12-14(19)13-18(21,5)6/h14H,7-13,19H2,1-6H3
InChIKeyVPJVMDSQKSBCEL-UHFFFAOYSA-N
XLogP2.53
TPSA66.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.50
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide?
The IUPAC name of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide (CID 108521516) is 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide.
What is the SMILES notation for 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide?
The canonical SMILES for 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide is CCCCN(CCC)C(=O)C(=O)N1C(C)(C)CC(N)CC1(C)C.
What is the InChIKey of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide?
The InChIKey is VPJVMDSQKSBCEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H35N3O2/c1-7-9-11-20(10-8-2)15(22)16(23)21-17(3,4)12-14(19)13-18(21,5)6/h14H,7-13,19H2,1-6H3.
What are the key properties of 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide?
2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide has a molecular weight of 325.50 g/mol, XLogP of 2.53, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-amino-2,2,6,6-tetramethylpiperidin-1-yl)-N-butyl-2-oxo-N-propylacetamide is sourced from PubChem (CID 108521516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).