(2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine

C8H13NO — CID 160679708

IUPAC(2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine
SMILESCC1=COC(N2C[C@H]2C)C1
InChIInChI=1S/C8H13NO/c1-6-3-8(10-5-6)9-4-7(9)2/h5,7-8H,3-4H2,1-2H3/t7-,8?,9?/m1/s1
InChIKeyRNZBTMXJVDEDIW-AFPNSQJFSA-N
MW139.20 g/mol
LogP1.34
Rot. Bonds1

About (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine

(2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine (PubChem CID 160679708) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine.

Molecular Properties

Compound Name(2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine
PubChem CID160679708
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name(2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine
SMILESCC1=COC(N2C[C@H]2C)C1
InChIInChI=1S/C8H13NO/c1-6-3-8(10-5-6)9-4-7(9)2/h5,7-8H,3-4H2,1-2H3/t7-,8?,9?/m1/s1
InChIKeyRNZBTMXJVDEDIW-AFPNSQJFSA-N
XLogP1.34
TPSA12.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 51.34
H-Bond Donors ≤ 50
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 (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine?
The IUPAC name of (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine (CID 160679708) is (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine.
What is the SMILES notation for (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine?
The canonical SMILES for (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine is CC1=COC(N2C[C@H]2C)C1.
What is the InChIKey of (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine?
The InChIKey is RNZBTMXJVDEDIW-AFPNSQJFSA-N. The full InChI is InChI=1S/C8H13NO/c1-6-3-8(10-5-6)9-4-7(9)2/h5,7-8H,3-4H2,1-2H3/t7-,8?,9?/m1/s1.
What are the key properties of (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine?
(2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine has a molecular weight of 139.20 g/mol, XLogP of 1.34, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-(4-methyl-2,3-dihydrofuran-2-yl)aziridine is sourced from PubChem (CID 160679708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).