N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine

C23H34N2 — CID 155394536

IUPACN,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine
SMILESCc1cccc(C)c1N(C)CC(C)(C)CN(C)c1c(C)cccc1C
InChIInChI=1S/C23H34N2/c1-17-11-9-12-18(2)21(17)24(7)15-23(5,6)16-25(8)22-19(3)13-10-14-20(22)4/h9-14H,15-16H2,1-8H3
InChIKeyKWLHUUHIUQGVES-UHFFFAOYSA-N
MW338.54 g/mol
LogP5.52
Rot. Bonds6

About N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine

N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine (PubChem CID 155394536) has the molecular formula C23H34N2 and a molecular weight of 338.54 g/mol. Its IUPAC name is N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine.

Molecular Properties

Compound NameN,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine
PubChem CID155394536
Molecular FormulaC23H34N2
Molecular Weight338.54 g/mol
Exact Mass338.27
IUPAC NameN,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine
SMILESCc1cccc(C)c1N(C)CC(C)(C)CN(C)c1c(C)cccc1C
InChIInChI=1S/C23H34N2/c1-17-11-9-12-18(2)21(17)24(7)15-23(5,6)16-25(8)22-19(3)13-10-14-20(22)4/h9-14H,15-16H2,1-8H3
InChIKeyKWLHUUHIUQGVES-UHFFFAOYSA-N
XLogP5.52
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.54
LogP ≤ 55.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine 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,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine?
The IUPAC name of N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine (CID 155394536) is N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine.
What is the SMILES notation for N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine?
The canonical SMILES for N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine is Cc1cccc(C)c1N(C)CC(C)(C)CN(C)c1c(C)cccc1C.
What is the InChIKey of N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine?
The InChIKey is KWLHUUHIUQGVES-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H34N2/c1-17-11-9-12-18(2)21(17)24(7)15-23(5,6)16-25(8)22-19(3)13-10-14-20(22)4/h9-14H,15-16H2,1-8H3.
What are the key properties of N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine?
N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine has a molecular weight of 338.54 g/mol, XLogP of 5.52, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2,6-dimethylphenyl)-N,N',2,2-tetramethylpropane-1,3-diamine is sourced from PubChem (CID 155394536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).