ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine

C8H18N2O — CID 91520593

IUPACethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine
SMILESC=C(C)N1COCN1C.CC
InChIInChI=1S/C6H12N2O.C2H6/c1-6(2)8-5-9-4-7(8)3;1-2/h1,4-5H2,2-3H3;1-2H3
InChIKeyAXFFPVMHXKRGMZ-UHFFFAOYSA-N
MW158.24 g/mol
LogP1.64
Rot. Bonds1

About ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine

ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine (PubChem CID 91520593) has the molecular formula C8H18N2O and a molecular weight of 158.24 g/mol. Its IUPAC name is ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine.

Molecular Properties

Compound Nameethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine
PubChem CID91520593
Molecular FormulaC8H18N2O
Molecular Weight158.24 g/mol
Exact Mass158.14
IUPAC Nameethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine
SMILESC=C(C)N1COCN1C.CC
InChIInChI=1S/C6H12N2O.C2H6/c1-6(2)8-5-9-4-7(8)3;1-2/h1,4-5H2,2-3H3;1-2H3
InChIKeyAXFFPVMHXKRGMZ-UHFFFAOYSA-N
XLogP1.64
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.24
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

ethane;1-methyl-2-prop-1-en-2-yldiazepan-5-one
CID 91474753
ethane;tris(2-methylprop-1-ene)
CID 144520420
3,5-dimethyl-1,3,5-oxadiazinan-4-ol
CID 166765421
ethane;1-prop-1-en-2-ylpiperidine
CID 142839582
2,3-dimethylbuta-1,3-diene;ethane
CID 156868132
ethane;5-methyl-1-oxa-5-azaspiro[3.3]heptane
CID 144685724
3-fluoro-8-prop-1-en-2-yl-1-oxa-3,8-diazaspiro[4.5]decane
CID 178034055
2-methylprop-2-en-1-ol;oxirane
CID 87800539
ethane;2-methyl-1-morpholin-4-ylprop-2-en-1-imine
CID 163273415
3-methyl-4-prop-1-en-2-ylmorpholine
CID 145355299
3,3-difluoro-4-methyl-1-prop-1-en-2-ylpiperidine
CID 170642221
ethane;1-methyl-4-(1-prop-1-en-2-ylazetidin-3-yl)piperazine
CID 142368232

Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine?
The IUPAC name of ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine (CID 91520593) is ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine.
What is the SMILES notation for ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine?
The canonical SMILES for ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine is C=C(C)N1COCN1C.CC.
What is the InChIKey of ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine?
The InChIKey is AXFFPVMHXKRGMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N2O.C2H6/c1-6(2)8-5-9-4-7(8)3;1-2/h1,4-5H2,2-3H3;1-2H3.
What are the key properties of ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine?
ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine has a molecular weight of 158.24 g/mol, XLogP of 1.64, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-4-prop-1-en-2-yl-1,3,4-oxadiazolidine is sourced from PubChem (CID 91520593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).