3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide

C14H28N4O2 — CID 19021275

IUPAC3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
SMILESCN(N)C(=O)CC(=O)N(C)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H28N4O2/c1-13(2)8-10(9-14(3,4)16-13)17(5)11(19)7-12(20)18(6)15/h10,16H,7-9,15H2,1-6H3
InChIKeyNLIXCRCPFSAYFZ-UHFFFAOYSA-N
MW284.40 g/mol
LogP0.48
Rot. Bonds3

About 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide

3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide (PubChem CID 19021275) has the molecular formula C14H28N4O2 and a molecular weight of 284.40 g/mol. Its IUPAC name is 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide.

Molecular Properties

Compound Name3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
PubChem CID19021275
Molecular FormulaC14H28N4O2
Molecular Weight284.40 g/mol
Exact Mass284.22
IUPAC Name3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide
SMILESCN(N)C(=O)CC(=O)N(C)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C14H28N4O2/c1-13(2)8-10(9-14(3,4)16-13)17(5)11(19)7-12(20)18(6)15/h10,16H,7-9,15H2,1-6H3
InChIKeyNLIXCRCPFSAYFZ-UHFFFAOYSA-N
XLogP0.48
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
The IUPAC name of 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide (CID 19021275) is 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide.
What is the SMILES notation for 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
The canonical SMILES for 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide is CN(N)C(=O)CC(=O)N(C)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
The InChIKey is NLIXCRCPFSAYFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N4O2/c1-13(2)8-10(9-14(3,4)16-13)17(5)11(19)7-12(20)18(6)15/h10,16H,7-9,15H2,1-6H3.
What are the key properties of 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide?
3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide has a molecular weight of 284.40 g/mol, XLogP of 0.48, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[amino(methyl)amino]-N-methyl-3-oxo-N-(2,2,6,6-tetramethylpiperidin-4-yl)propanamide is sourced from PubChem (CID 19021275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).