N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine

C23H48N4 — CID 22892299

IUPACN-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine
SMILESCCCN(CN(C)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C23H48N4/c1-11-12-27(19-15-22(6,7)25-23(8,9)16-19)17-26(10)18-13-20(2,3)24-21(4,5)14-18/h18-19,24-25H,11-17H2,1-10H3
InChIKeyXYEUSLJACXXWBK-UHFFFAOYSA-N
MW380.67 g/mol
LogP4.21
Rot. Bonds6

About N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine

N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine (PubChem CID 22892299) has the molecular formula C23H48N4 and a molecular weight of 380.67 g/mol. Its IUPAC name is N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine.

Molecular Properties

Compound NameN-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine
PubChem CID22892299
Molecular FormulaC23H48N4
Molecular Weight380.67 g/mol
Exact Mass380.39
IUPAC NameN-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine
SMILESCCCN(CN(C)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C23H48N4/c1-11-12-27(19-15-22(6,7)25-23(8,9)16-19)17-26(10)18-13-20(2,3)24-21(4,5)14-18/h18-19,24-25H,11-17H2,1-10H3
InChIKeyXYEUSLJACXXWBK-UHFFFAOYSA-N
XLogP4.21
TPSA30.54 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.67
LogP ≤ 54.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine?
The IUPAC name of N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine (CID 22892299) is N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine.
What is the SMILES notation for N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine?
The canonical SMILES for N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine is CCCN(CN(C)C1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine?
The InChIKey is XYEUSLJACXXWBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48N4/c1-11-12-27(19-15-22(6,7)25-23(8,9)16-19)17-26(10)18-13-20(2,3)24-21(4,5)14-18/h18-19,24-25H,11-17H2,1-10H3.
What are the key properties of N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine?
N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine has a molecular weight of 380.67 g/mol, XLogP of 4.21, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N'-propyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)methanediamine is sourced from PubChem (CID 22892299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).