1-N,1-N',1-N'-trimethylethene-1,1-diamine

C5H12N2 — CID 22047908

IUPAC1-N,1-N',1-N'-trimethylethene-1,1-diamine
SMILESC=C(NC)N(C)C
InChIInChI=1S/C5H12N2/c1-5(6-2)7(3)4/h6H,1H2,2-4H3
InChIKeyRNTBDUAJBIVMDA-UHFFFAOYSA-N
MW100.16 g/mol
LogP0.24
Rot. Bonds2

About 1-N,1-N',1-N'-trimethylethene-1,1-diamine

1-N,1-N',1-N'-trimethylethene-1,1-diamine (PubChem CID 22047908) has the molecular formula C5H12N2 and a molecular weight of 100.16 g/mol. Its IUPAC name is 1-N,1-N',1-N'-trimethylethene-1,1-diamine.

Molecular Properties

Compound Name1-N,1-N',1-N'-trimethylethene-1,1-diamine
PubChem CID22047908
Molecular FormulaC5H12N2
Molecular Weight100.16 g/mol
Exact Mass100.10
IUPAC Name1-N,1-N',1-N'-trimethylethene-1,1-diamine
SMILESC=C(NC)N(C)C
InChIInChI=1S/C5H12N2/c1-5(6-2)7(3)4/h6H,1H2,2-4H3
InChIKeyRNTBDUAJBIVMDA-UHFFFAOYSA-N
XLogP0.24
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.16
LogP ≤ 50.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-N,1-N',1-N'-trimethylethene-1,1-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 1-N,1-N',1-N'-trimethylethene-1,1-diamine?
The IUPAC name of 1-N,1-N',1-N'-trimethylethene-1,1-diamine (CID 22047908) is 1-N,1-N',1-N'-trimethylethene-1,1-diamine.
What is the SMILES notation for 1-N,1-N',1-N'-trimethylethene-1,1-diamine?
The canonical SMILES for 1-N,1-N',1-N'-trimethylethene-1,1-diamine is C=C(NC)N(C)C.
What is the InChIKey of 1-N,1-N',1-N'-trimethylethene-1,1-diamine?
The InChIKey is RNTBDUAJBIVMDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-5(6-2)7(3)4/h6H,1H2,2-4H3.
What are the key properties of 1-N,1-N',1-N'-trimethylethene-1,1-diamine?
1-N,1-N',1-N'-trimethylethene-1,1-diamine has a molecular weight of 100.16 g/mol, XLogP of 0.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N',1-N'-trimethylethene-1,1-diamine is sourced from PubChem (CID 22047908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).