(2R)-2-methyl-1-oxidoaziridine

C3H6NO- — CID 101244990

IUPAC(2R)-2-methyl-1-oxidoaziridine
SMILESC[C@@H]1CN1[O-]
InChIInChI=1S/C3H6NO/c1-3-2-4(3)5/h3H,2H2,1H3/q-1/t3-,4?/m1/s1
InChIKeyGRZIELGMIAACTM-SYPWQXSBSA-N
MW72.09 g/mol
LogP0.19
Rot. Bonds

About (2R)-2-methyl-1-oxidoaziridine

(2R)-2-methyl-1-oxidoaziridine (PubChem CID 101244990) has the molecular formula C3H6NO- and a molecular weight of 72.09 g/mol. Its IUPAC name is (2R)-2-methyl-1-oxidoaziridine.

Molecular Properties

Compound Name(2R)-2-methyl-1-oxidoaziridine
PubChem CID101244990
Molecular FormulaC3H6NO-
Molecular Weight72.09 g/mol
Exact Mass72.05
IUPAC Name(2R)-2-methyl-1-oxidoaziridine
SMILESC[C@@H]1CN1[O-]
InChIInChI=1S/C3H6NO/c1-3-2-4(3)5/h3H,2H2,1H3/q-1/t3-,4?/m1/s1
InChIKeyGRZIELGMIAACTM-SYPWQXSBSA-N
XLogP0.19
TPSA26.07 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50072.09
LogP ≤ 50.19
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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Related Compounds

2,5-dimethyl-1-oxidopiperidine
CID 163437717
(2S)-1-bromo-2-methylaziridine
CID 134926712
1-iodo-2-methylaziridine
CID 139722499
(2R,5S)-1,4-dichloro-2,5-dimethylpiperazine
CID 129411829
(2,5-dimethyl-4-silylpiperazin-1-yl)silane
CID 123216940
(2S,5S)-1,4-dihydroxy-2,5-dimethylpiperazine
CID 175346878
ethane;1,2,4,5-tetramethylpiperazine
CID 164865311
4-methyl-2-oxido-1,2-oxazolidine
CID 163537436
(4,5-dimethyl-1-oxidopiperidin-2-yl)-methylideneborane
CID 163533265
(2S)-1-cyclopropyl-2-methylaziridine
CID 147795465
1-tert-butyl-2-methylaziridine
CID 15557486
1,2,4,6-tetramethylpiperazine
CID 22088083

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-1-oxidoaziridine?
The IUPAC name of (2R)-2-methyl-1-oxidoaziridine (CID 101244990) is (2R)-2-methyl-1-oxidoaziridine.
What is the SMILES notation for (2R)-2-methyl-1-oxidoaziridine?
The canonical SMILES for (2R)-2-methyl-1-oxidoaziridine is C[C@@H]1CN1[O-].
What is the InChIKey of (2R)-2-methyl-1-oxidoaziridine?
The InChIKey is GRZIELGMIAACTM-SYPWQXSBSA-N. The full InChI is InChI=1S/C3H6NO/c1-3-2-4(3)5/h3H,2H2,1H3/q-1/t3-,4?/m1/s1.
What are the key properties of (2R)-2-methyl-1-oxidoaziridine?
(2R)-2-methyl-1-oxidoaziridine has a molecular weight of 72.09 g/mol, XLogP of 0.19, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-1-oxidoaziridine is sourced from PubChem (CID 101244990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).