N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine

C22H46N4 — CID 18736408

IUPACN'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine
SMILESCN(CNC1CC(C)(C)N(C)C(C)(C)C1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C22H46N4/c1-19(2)12-17(13-20(3,4)25(19)10)23-16-24(9)18-14-21(5,6)26(11)22(7,8)15-18/h17-18,23H,12-16H2,1-11H3
InChIKeyZIMAPQMZXNWZMB-UHFFFAOYSA-N
MW366.64 g/mol
LogP3.77
Rot. Bonds4

About N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine

N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine (PubChem CID 18736408) has the molecular formula C22H46N4 and a molecular weight of 366.64 g/mol. Its IUPAC name is N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine.

Molecular Properties

Compound NameN'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine
PubChem CID18736408
Molecular FormulaC22H46N4
Molecular Weight366.64 g/mol
Exact Mass366.37
IUPAC NameN'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine
SMILESCN(CNC1CC(C)(C)N(C)C(C)(C)C1)C1CC(C)(C)N(C)C(C)(C)C1
InChIInChI=1S/C22H46N4/c1-19(2)12-17(13-20(3,4)25(19)10)23-16-24(9)18-14-21(5,6)26(11)22(7,8)15-18/h17-18,23H,12-16H2,1-11H3
InChIKeyZIMAPQMZXNWZMB-UHFFFAOYSA-N
XLogP3.77
TPSA21.75 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.64
LogP ≤ 53.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine?
The IUPAC name of N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine (CID 18736408) is N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine.
What is the SMILES notation for N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine?
The canonical SMILES for N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine is CN(CNC1CC(C)(C)N(C)C(C)(C)C1)C1CC(C)(C)N(C)C(C)(C)C1.
What is the InChIKey of N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine?
The InChIKey is ZIMAPQMZXNWZMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46N4/c1-19(2)12-17(13-20(3,4)25(19)10)23-16-24(9)18-14-21(5,6)26(11)22(7,8)15-18/h17-18,23H,12-16H2,1-11H3.
What are the key properties of N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine?
N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine has a molecular weight of 366.64 g/mol, XLogP of 3.77, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N,N'-bis(1,2,2,6,6-pentamethylpiperidin-4-yl)methanediamine is sourced from PubChem (CID 18736408), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).