N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide

C23H44N4O3 — CID 23393137

IUPACN'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide
SMILESCON1C(C)(C)CC(NC(=O)CC(=O)NC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C23H44N4O3/c1-20(2)12-16(13-21(3,4)26(20)9)24-18(28)11-19(29)25-17-14-22(5,6)27(30-10)23(7,8)15-17/h16-17H,11-15H2,1-10H3,(H,24,28)(H,25,29)
InChIKeyDWYMZLOJANQDIR-UHFFFAOYSA-N
MW424.63 g/mol
LogP2.84
Rot. Bonds5

About N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide

N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide (PubChem CID 23393137) has the molecular formula C23H44N4O3 and a molecular weight of 424.63 g/mol. Its IUPAC name is N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide.

Molecular Properties

Compound NameN'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide
PubChem CID23393137
Molecular FormulaC23H44N4O3
Molecular Weight424.63 g/mol
Exact Mass424.34
IUPAC NameN'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide
SMILESCON1C(C)(C)CC(NC(=O)CC(=O)NC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C
InChIInChI=1S/C23H44N4O3/c1-20(2)12-16(13-21(3,4)26(20)9)24-18(28)11-19(29)25-17-14-22(5,6)27(30-10)23(7,8)15-17/h16-17H,11-15H2,1-10H3,(H,24,28)(H,25,29)
InChIKeyDWYMZLOJANQDIR-UHFFFAOYSA-N
XLogP2.84
TPSA73.91 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.63
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide?
The IUPAC name of N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide (CID 23393137) is N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide.
What is the SMILES notation for N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide?
The canonical SMILES for N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide is CON1C(C)(C)CC(NC(=O)CC(=O)NC2CC(C)(C)N(C)C(C)(C)C2)CC1(C)C.
What is the InChIKey of N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide?
The InChIKey is DWYMZLOJANQDIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H44N4O3/c1-20(2)12-16(13-21(3,4)26(20)9)24-18(28)11-19(29)25-17-14-22(5,6)27(30-10)23(7,8)15-17/h16-17H,11-15H2,1-10H3,(H,24,28)(H,25,29).
What are the key properties of N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide?
N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide has a molecular weight of 424.63 g/mol, XLogP of 2.84, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-methoxy-2,2,6,6-tetramethylpiperidin-4-yl)-N-(1,2,2,6,6-pentamethylpiperidin-4-yl)propanediamide is sourced from PubChem (CID 23393137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).