N-ethyl-N-methylaziridin-2-amine

C5H12N2 — CID 146352079

IUPACN-ethyl-N-methylaziridin-2-amine
SMILESCCN(C)C1CN1
InChIInChI=1S/C5H12N2/c1-3-7(2)5-4-6-5/h5-6H,3-4H2,1-2H3
InChIKeyAKKFEDNYLZKAHV-UHFFFAOYSA-N
MW100.17 g/mol
LogP-0.13
Rot. Bonds2

About N-ethyl-N-methylaziridin-2-amine

N-ethyl-N-methylaziridin-2-amine (PubChem CID 146352079) has the molecular formula C5H12N2 and a molecular weight of 100.17 g/mol. Its IUPAC name is N-ethyl-N-methylaziridin-2-amine.

Molecular Properties

Compound NameN-ethyl-N-methylaziridin-2-amine
PubChem CID146352079
Molecular FormulaC5H12N2
Molecular Weight100.17 g/mol
Exact Mass100.10
IUPAC NameN-ethyl-N-methylaziridin-2-amine
SMILESCCN(C)C1CN1
InChIInChI=1S/C5H12N2/c1-3-7(2)5-4-6-5/h5-6H,3-4H2,1-2H3
InChIKeyAKKFEDNYLZKAHV-UHFFFAOYSA-N
XLogP-0.13
TPSA25.18 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.17
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-methylaziridin-2-amine?
The IUPAC name of N-ethyl-N-methylaziridin-2-amine (CID 146352079) is N-ethyl-N-methylaziridin-2-amine.
What is the SMILES notation for N-ethyl-N-methylaziridin-2-amine?
The canonical SMILES for N-ethyl-N-methylaziridin-2-amine is CCN(C)C1CN1.
What is the InChIKey of N-ethyl-N-methylaziridin-2-amine?
The InChIKey is AKKFEDNYLZKAHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2/c1-3-7(2)5-4-6-5/h5-6H,3-4H2,1-2H3.
What are the key properties of N-ethyl-N-methylaziridin-2-amine?
N-ethyl-N-methylaziridin-2-amine has a molecular weight of 100.17 g/mol, XLogP of -0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methylaziridin-2-amine is sourced from PubChem (CID 146352079), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).