5-(aziridin-2-yl)-2-methylpyridine

C8H10N2 — CID 129016898

IUPAC5-(aziridin-2-yl)-2-methylpyridine
SMILESCc1ccc(C2CN2)cn1
InChIInChI=1S/C8H10N2/c1-6-2-3-7(4-9-6)8-5-10-8/h2-4,8,10H,5H2,1H3
InChIKeySAQNEDZTQHTMFD-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.03
Rot. Bonds1

About 5-(aziridin-2-yl)-2-methylpyridine

5-(aziridin-2-yl)-2-methylpyridine (PubChem CID 129016898) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 5-(aziridin-2-yl)-2-methylpyridine.

Molecular Properties

Compound Name5-(aziridin-2-yl)-2-methylpyridine
PubChem CID129016898
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name5-(aziridin-2-yl)-2-methylpyridine
SMILESCc1ccc(C2CN2)cn1
InChIInChI=1S/C8H10N2/c1-6-2-3-7(4-9-6)8-5-10-8/h2-4,8,10H,5H2,1H3
InChIKeySAQNEDZTQHTMFD-UHFFFAOYSA-N
XLogP1.03
TPSA34.83 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.03
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 5-(aziridin-2-yl)-2-methylpyridine?
The IUPAC name of 5-(aziridin-2-yl)-2-methylpyridine (CID 129016898) is 5-(aziridin-2-yl)-2-methylpyridine.
What is the SMILES notation for 5-(aziridin-2-yl)-2-methylpyridine?
The canonical SMILES for 5-(aziridin-2-yl)-2-methylpyridine is Cc1ccc(C2CN2)cn1.
What is the InChIKey of 5-(aziridin-2-yl)-2-methylpyridine?
The InChIKey is SAQNEDZTQHTMFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-6-2-3-7(4-9-6)8-5-10-8/h2-4,8,10H,5H2,1H3.
What are the key properties of 5-(aziridin-2-yl)-2-methylpyridine?
5-(aziridin-2-yl)-2-methylpyridine has a molecular weight of 134.18 g/mol, XLogP of 1.03, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aziridin-2-yl)-2-methylpyridine is sourced from PubChem (CID 129016898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).