2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine

C9H21N3 — CID 166688412

IUPAC2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine
SMILESCN(C)CCC1(C)CNCN1C
InChIInChI=1S/C9H21N3/c1-9(5-6-11(2)3)7-10-8-12(9)4/h10H,5-8H2,1-4H3
InChIKeyLKNDJUKKEPAXML-UHFFFAOYSA-N
MW171.29 g/mol
LogP0.19
Rot. Bonds3

About 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine

2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine (PubChem CID 166688412) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine
PubChem CID166688412
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC Name2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine
SMILESCN(C)CCC1(C)CNCN1C
InChIInChI=1S/C9H21N3/c1-9(5-6-11(2)3)7-10-8-12(9)4/h10H,5-8H2,1-4H3
InChIKeyLKNDJUKKEPAXML-UHFFFAOYSA-N
XLogP0.19
TPSA18.51 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.29
LogP ≤ 50.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine?
The IUPAC name of 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine (CID 166688412) is 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine is CN(C)CCC1(C)CNCN1C.
What is the InChIKey of 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine?
The InChIKey is LKNDJUKKEPAXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21N3/c1-9(5-6-11(2)3)7-10-8-12(9)4/h10H,5-8H2,1-4H3.
What are the key properties of 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine?
2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine has a molecular weight of 171.29 g/mol, XLogP of 0.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylimidazolidin-4-yl)-N,N-dimethylethanamine is sourced from PubChem (CID 166688412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).