N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine

C13H28N2O — CID 3018748

IUPACN-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCOCCCNC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C13H28N2O/c1-12(2)9-11(10-13(3,4)15-12)14-7-6-8-16-5/h11,14-15H,6-10H2,1-5H3
InChIKeyVDGDCVKCGHKYJP-UHFFFAOYSA-N
MW228.38 g/mol
LogP1.92
Rot. Bonds5

About N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine

N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine (PubChem CID 3018748) has the molecular formula C13H28N2O and a molecular weight of 228.38 g/mol. Its IUPAC name is N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine.

Molecular Properties

Compound NameN-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine
PubChem CID3018748
Molecular FormulaC13H28N2O
Molecular Weight228.38 g/mol
Exact Mass228.22
IUPAC NameN-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine
SMILESCOCCCNC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C13H28N2O/c1-12(2)9-11(10-13(3,4)15-12)14-7-6-8-16-5/h11,14-15H,6-10H2,1-5H3
InChIKeyVDGDCVKCGHKYJP-UHFFFAOYSA-N
XLogP1.92
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.38
LogP ≤ 51.92
H-Bond Donors ≤ 52
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-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine?
The IUPAC name of N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine (CID 3018748) is N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine.
What is the SMILES notation for N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine?
The canonical SMILES for N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine is COCCCNC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine?
The InChIKey is VDGDCVKCGHKYJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O/c1-12(2)9-11(10-13(3,4)15-12)14-7-6-8-16-5/h11,14-15H,6-10H2,1-5H3.
What are the key properties of N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine?
N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine has a molecular weight of 228.38 g/mol, XLogP of 1.92, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methoxypropyl)-2,2,6,6-tetramethylpiperidin-4-amine is sourced from PubChem (CID 3018748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).