(2R)-1,2-dimethyl-2-phenylaziridine

C10H13N — CID 102030003

IUPAC(2R)-1,2-dimethyl-2-phenylaziridine
SMILESCN1C[C@@]1(C)c1ccccc1
InChIInChI=1S/C10H13N/c1-10(8-11(10)2)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3/t10-,11?/m0/s1
InChIKeyAIPKEAOFPLLFHI-VUWPPUDQSA-N
MW147.22 g/mol
LogP1.85
Rot. Bonds1

About (2R)-1,2-dimethyl-2-phenylaziridine

(2R)-1,2-dimethyl-2-phenylaziridine (PubChem CID 102030003) has the molecular formula C10H13N and a molecular weight of 147.22 g/mol. Its IUPAC name is (2R)-1,2-dimethyl-2-phenylaziridine.

Molecular Properties

Compound Name(2R)-1,2-dimethyl-2-phenylaziridine
PubChem CID102030003
Molecular FormulaC10H13N
Molecular Weight147.22 g/mol
Exact Mass147.10
IUPAC Name(2R)-1,2-dimethyl-2-phenylaziridine
SMILESCN1C[C@@]1(C)c1ccccc1
InChIInChI=1S/C10H13N/c1-10(8-11(10)2)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3/t10-,11?/m0/s1
InChIKeyAIPKEAOFPLLFHI-VUWPPUDQSA-N
XLogP1.85
TPSA3.01 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.22
LogP ≤ 51.85
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 (2R)-1,2-dimethyl-2-phenylaziridine?
The IUPAC name of (2R)-1,2-dimethyl-2-phenylaziridine (CID 102030003) is (2R)-1,2-dimethyl-2-phenylaziridine.
What is the SMILES notation for (2R)-1,2-dimethyl-2-phenylaziridine?
The canonical SMILES for (2R)-1,2-dimethyl-2-phenylaziridine is CN1C[C@@]1(C)c1ccccc1.
What is the InChIKey of (2R)-1,2-dimethyl-2-phenylaziridine?
The InChIKey is AIPKEAOFPLLFHI-VUWPPUDQSA-N. The full InChI is InChI=1S/C10H13N/c1-10(8-11(10)2)9-6-4-3-5-7-9/h3-7H,8H2,1-2H3/t10-,11?/m0/s1.
What are the key properties of (2R)-1,2-dimethyl-2-phenylaziridine?
(2R)-1,2-dimethyl-2-phenylaziridine has a molecular weight of 147.22 g/mol, XLogP of 1.85, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,2-dimethyl-2-phenylaziridine is sourced from PubChem (CID 102030003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).