2-tert-butyl-4-methylidene-1,3-oxazolidine

C8H15NO — CID 170416242

IUPAC2-tert-butyl-4-methylidene-1,3-oxazolidine
SMILESC=C1COC(C(C)(C)C)N1
InChIInChI=1S/C8H15NO/c1-6-5-10-7(9-6)8(2,3)4/h7,9H,1,5H2,2-4H3
InChIKeyBTCZIKNVFXVYAF-UHFFFAOYSA-N
MW141.21 g/mol
LogP1.49
Rot. Bonds

About 2-tert-butyl-4-methylidene-1,3-oxazolidine

2-tert-butyl-4-methylidene-1,3-oxazolidine (PubChem CID 170416242) has the molecular formula C8H15NO and a molecular weight of 141.21 g/mol. Its IUPAC name is 2-tert-butyl-4-methylidene-1,3-oxazolidine.

Molecular Properties

Compound Name2-tert-butyl-4-methylidene-1,3-oxazolidine
PubChem CID170416242
Molecular FormulaC8H15NO
Molecular Weight141.21 g/mol
Exact Mass141.12
IUPAC Name2-tert-butyl-4-methylidene-1,3-oxazolidine
SMILESC=C1COC(C(C)(C)C)N1
InChIInChI=1S/C8H15NO/c1-6-5-10-7(9-6)8(2,3)4/h7,9H,1,5H2,2-4H3
InChIKeyBTCZIKNVFXVYAF-UHFFFAOYSA-N
XLogP1.49
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Prop-1-en-2-yl-1,3-oxazolidine
CID 54277332
4-Methyl-2-prop-1-en-2-yl-1,3-oxazolidine
CID 68827199
4-Ethyl-2-prop-1-en-2-yl-1,3-oxazolidine
CID 68827316
2-methyl-N-(3-propoxyprop-1-en-2-yl)propan-1-amine
CID 132050825
4,4-Dimethyl-2-prop-1-en-2-yl-1,3-oxazolidine
CID 141033258

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-4-methylidene-1,3-oxazolidine?
The IUPAC name of 2-tert-butyl-4-methylidene-1,3-oxazolidine (CID 170416242) is 2-tert-butyl-4-methylidene-1,3-oxazolidine.
What is the SMILES notation for 2-tert-butyl-4-methylidene-1,3-oxazolidine?
The canonical SMILES for 2-tert-butyl-4-methylidene-1,3-oxazolidine is C=C1COC(C(C)(C)C)N1.
What is the InChIKey of 2-tert-butyl-4-methylidene-1,3-oxazolidine?
The InChIKey is BTCZIKNVFXVYAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO/c1-6-5-10-7(9-6)8(2,3)4/h7,9H,1,5H2,2-4H3.
What are the key properties of 2-tert-butyl-4-methylidene-1,3-oxazolidine?
2-tert-butyl-4-methylidene-1,3-oxazolidine has a molecular weight of 141.21 g/mol, XLogP of 1.49, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-4-methylidene-1,3-oxazolidine is sourced from PubChem (CID 170416242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).