1-(2-ethylpentyl)-2-methylaziridine

C10H21N — CID 123441048

IUPAC1-(2-ethylpentyl)-2-methylaziridine
SMILESCCCC(CC)CN1CC1C
InChIInChI=1S/C10H21N/c1-4-6-10(5-2)8-11-7-9(11)3/h9-10H,4-8H2,1-3H3
InChIKeyRSDUCWVGLQMVDE-UHFFFAOYSA-N
MW155.28 g/mol
LogP2.52
Rot. Bonds5

About 1-(2-ethylpentyl)-2-methylaziridine

1-(2-ethylpentyl)-2-methylaziridine (PubChem CID 123441048) has the molecular formula C10H21N and a molecular weight of 155.28 g/mol. Its IUPAC name is 1-(2-ethylpentyl)-2-methylaziridine.

Molecular Properties

Compound Name1-(2-ethylpentyl)-2-methylaziridine
PubChem CID123441048
Molecular FormulaC10H21N
Molecular Weight155.28 g/mol
Exact Mass155.17
IUPAC Name1-(2-ethylpentyl)-2-methylaziridine
SMILESCCCC(CC)CN1CC1C
InChIInChI=1S/C10H21N/c1-4-6-10(5-2)8-11-7-9(11)3/h9-10H,4-8H2,1-3H3
InChIKeyRSDUCWVGLQMVDE-UHFFFAOYSA-N
XLogP2.52
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.28
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 1-(2-ethylpentyl)-2-methylaziridine?
The IUPAC name of 1-(2-ethylpentyl)-2-methylaziridine (CID 123441048) is 1-(2-ethylpentyl)-2-methylaziridine.
What is the SMILES notation for 1-(2-ethylpentyl)-2-methylaziridine?
The canonical SMILES for 1-(2-ethylpentyl)-2-methylaziridine is CCCC(CC)CN1CC1C.
What is the InChIKey of 1-(2-ethylpentyl)-2-methylaziridine?
The InChIKey is RSDUCWVGLQMVDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N/c1-4-6-10(5-2)8-11-7-9(11)3/h9-10H,4-8H2,1-3H3.
What are the key properties of 1-(2-ethylpentyl)-2-methylaziridine?
1-(2-ethylpentyl)-2-methylaziridine has a molecular weight of 155.28 g/mol, XLogP of 2.52, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylpentyl)-2-methylaziridine is sourced from PubChem (CID 123441048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).