2,3-dimethylimidazolidin-1-amine

C5H13N3 — CID 123893474

IUPAC2,3-dimethylimidazolidin-1-amine
SMILESCC1N(C)CCN1N
InChIInChI=1S/C5H13N3/c1-5-7(2)3-4-8(5)6/h5H,3-4,6H2,1-2H3
InChIKeyAUJUFOYSJGWCLY-UHFFFAOYSA-N
MW115.18 g/mol
LogP-0.55
Rot. Bonds

About 2,3-dimethylimidazolidin-1-amine

2,3-dimethylimidazolidin-1-amine (PubChem CID 123893474) has the molecular formula C5H13N3 and a molecular weight of 115.18 g/mol. Its IUPAC name is 2,3-dimethylimidazolidin-1-amine.

Molecular Properties

Compound Name2,3-dimethylimidazolidin-1-amine
PubChem CID123893474
Molecular FormulaC5H13N3
Molecular Weight115.18 g/mol
Exact Mass115.11
IUPAC Name2,3-dimethylimidazolidin-1-amine
SMILESCC1N(C)CCN1N
InChIInChI=1S/C5H13N3/c1-5-7(2)3-4-8(5)6/h5H,3-4,6H2,1-2H3
InChIKeyAUJUFOYSJGWCLY-UHFFFAOYSA-N
XLogP-0.55
TPSA32.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500115.18
LogP ≤ 5-0.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylimidazolidin-1-amine?
The IUPAC name of 2,3-dimethylimidazolidin-1-amine (CID 123893474) is 2,3-dimethylimidazolidin-1-amine.
What is the SMILES notation for 2,3-dimethylimidazolidin-1-amine?
The canonical SMILES for 2,3-dimethylimidazolidin-1-amine is CC1N(C)CCN1N.
What is the InChIKey of 2,3-dimethylimidazolidin-1-amine?
The InChIKey is AUJUFOYSJGWCLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N3/c1-5-7(2)3-4-8(5)6/h5H,3-4,6H2,1-2H3.
What are the key properties of 2,3-dimethylimidazolidin-1-amine?
2,3-dimethylimidazolidin-1-amine has a molecular weight of 115.18 g/mol, XLogP of -0.55, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylimidazolidin-1-amine is sourced from PubChem (CID 123893474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).