6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide

C19H38N4O2 — CID 67848255

IUPAC6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide
SMILESCCCCN1C(C)(C)CC(N(N)C(=O)CCCCC(N)=O)CC1(C)C
InChIInChI=1S/C19H38N4O2/c1-6-7-12-22-18(2,3)13-15(14-19(22,4)5)23(21)17(25)11-9-8-10-16(20)24/h15H,6-14,21H2,1-5H3,(H2,20,24)
InChIKeyLZGQGLKVLVPDSG-UHFFFAOYSA-N
MW354.54 g/mol
LogP2.56
Rot. Bonds9

About 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide

6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide (PubChem CID 67848255) has the molecular formula C19H38N4O2 and a molecular weight of 354.54 g/mol. Its IUPAC name is 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide.

Molecular Properties

Compound Name6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide
PubChem CID67848255
Molecular FormulaC19H38N4O2
Molecular Weight354.54 g/mol
Exact Mass354.30
IUPAC Name6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide
SMILESCCCCN1C(C)(C)CC(N(N)C(=O)CCCCC(N)=O)CC1(C)C
InChIInChI=1S/C19H38N4O2/c1-6-7-12-22-18(2,3)13-15(14-19(22,4)5)23(21)17(25)11-9-8-10-16(20)24/h15H,6-14,21H2,1-5H3,(H2,20,24)
InChIKeyLZGQGLKVLVPDSG-UHFFFAOYSA-N
XLogP2.56
TPSA92.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.54
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', '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 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide?
The IUPAC name of 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide (CID 67848255) is 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide.
What is the SMILES notation for 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide?
The canonical SMILES for 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide is CCCCN1C(C)(C)CC(N(N)C(=O)CCCCC(N)=O)CC1(C)C.
What is the InChIKey of 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide?
The InChIKey is LZGQGLKVLVPDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H38N4O2/c1-6-7-12-22-18(2,3)13-15(14-19(22,4)5)23(21)17(25)11-9-8-10-16(20)24/h15H,6-14,21H2,1-5H3,(H2,20,24).
What are the key properties of 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide?
6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide has a molecular weight of 354.54 g/mol, XLogP of 2.56, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[amino-(1-butyl-2,2,6,6-tetramethylpiperidin-4-yl)amino]-6-oxohexanamide is sourced from PubChem (CID 67848255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).