(3R)-3-methyl-2-propan-2-yloxaziridine

C5H11NO — CID 124582025

IUPAC(3R)-3-methyl-2-propan-2-yloxaziridine
SMILESCC(C)N1O[C@@H]1C
InChIInChI=1S/C5H11NO/c1-4(2)6-5(3)7-6/h4-5H,1-3H3/t5-,6?/m1/s1
InChIKeyNNMAOFDNCCCMFJ-LWOQYNTDSA-N
MW101.15 g/mol
LogP0.99
Rot. Bonds1

About (3R)-3-methyl-2-propan-2-yloxaziridine

(3R)-3-methyl-2-propan-2-yloxaziridine (PubChem CID 124582025) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is (3R)-3-methyl-2-propan-2-yloxaziridine.

Molecular Properties

Compound Name(3R)-3-methyl-2-propan-2-yloxaziridine
PubChem CID124582025
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name(3R)-3-methyl-2-propan-2-yloxaziridine
SMILESCC(C)N1O[C@@H]1C
InChIInChI=1S/C5H11NO/c1-4(2)6-5(3)7-6/h4-5H,1-3H3/t5-,6?/m1/s1
InChIKeyNNMAOFDNCCCMFJ-LWOQYNTDSA-N
XLogP0.99
TPSA15.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 50.99
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

2,3-di(propan-2-yl)oxaziridine
CID 14491249
methoxy-(3-methyloxaziridin-2-yl)methanol
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(3S,4R,5S)-5-methyl-4-nitro-3-phenyl-2-propan-2-yl-1,2-oxazolidine
CID 10037741
(2S)-2-methyl-1-propan-2-ylazetidine
CID 118390770
3,3,6-trimethyl-1-propan-2-yl-4,5,6,6a-tetrahydro-3aH-cyclopenta[c][1,2]oxazole
CID 176902625
2,6,7-trimethyl-4-propan-2-yl-1,4-oxazepane
CID 176594257
3-ethyl-2-propan-2-yl-1,2-oxazolidine
CID 170275832
(2R,5R)-2,5-dimethyl-1-propan-2-ylpyrrolidine
CID 58977160
3,4-dimethyl-1-propan-2-ylpyrrolidine
CID 20737893
2-methyl-1-propan-2-yl-3-oxa-1-azaspiro[4.4]nonane
CID 138605795
2-methylpropane;tungsten
CID 144526928
(2R)-1,2,3-trimethylaziridine
CID 154470039

Frequently Asked Questions

What is the IUPAC name of (3R)-3-methyl-2-propan-2-yloxaziridine?
The IUPAC name of (3R)-3-methyl-2-propan-2-yloxaziridine (CID 124582025) is (3R)-3-methyl-2-propan-2-yloxaziridine.
What is the SMILES notation for (3R)-3-methyl-2-propan-2-yloxaziridine?
The canonical SMILES for (3R)-3-methyl-2-propan-2-yloxaziridine is CC(C)N1O[C@@H]1C.
What is the InChIKey of (3R)-3-methyl-2-propan-2-yloxaziridine?
The InChIKey is NNMAOFDNCCCMFJ-LWOQYNTDSA-N. The full InChI is InChI=1S/C5H11NO/c1-4(2)6-5(3)7-6/h4-5H,1-3H3/t5-,6?/m1/s1.
What are the key properties of (3R)-3-methyl-2-propan-2-yloxaziridine?
(3R)-3-methyl-2-propan-2-yloxaziridine has a molecular weight of 101.15 g/mol, XLogP of 0.99, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-methyl-2-propan-2-yloxaziridine is sourced from PubChem (CID 124582025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).