N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine

C22H46N4 — CID 19009850

IUPACN'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine
SMILESCN(CCCNC1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C22H46N4/c1-19(2)13-17(14-20(3,4)24-19)23-11-10-12-26(9)18-15-21(5,6)25-22(7,8)16-18/h17-18,23-25H,10-16H2,1-9H3
InChIKeySAQVUJYDDAATHF-UHFFFAOYSA-N
MW366.64 g/mol
LogP3.52
Rot. Bonds6

About N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine

N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine (PubChem CID 19009850) has the molecular formula C22H46N4 and a molecular weight of 366.64 g/mol. Its IUPAC name is N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine.

Molecular Properties

Compound NameN'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine
PubChem CID19009850
Molecular FormulaC22H46N4
Molecular Weight366.64 g/mol
Exact Mass366.37
IUPAC NameN'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine
SMILESCN(CCCNC1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C22H46N4/c1-19(2)13-17(14-20(3,4)24-19)23-11-10-12-26(9)18-15-21(5,6)25-22(7,8)16-18/h17-18,23-25H,10-16H2,1-9H3
InChIKeySAQVUJYDDAATHF-UHFFFAOYSA-N
XLogP3.52
TPSA39.33 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.64
LogP ≤ 53.52
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?
The IUPAC name of N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine (CID 19009850) is N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine.
What is the SMILES notation for N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?
The canonical SMILES for N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine is CN(CCCNC1CC(C)(C)NC(C)(C)C1)C1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?
The InChIKey is SAQVUJYDDAATHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46N4/c1-19(2)13-17(14-20(3,4)24-19)23-11-10-12-26(9)18-15-21(5,6)25-22(7,8)16-18/h17-18,23-25H,10-16H2,1-9H3.
What are the key properties of N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine?
N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine has a molecular weight of 366.64 g/mol, XLogP of 3.52, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-N,N'-bis(2,2,6,6-tetramethylpiperidin-4-yl)propane-1,3-diamine is sourced from PubChem (CID 19009850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).