2-(2-methylpropylidene)-1,3-oxazolidine

C7H13NO — CID 174399163

IUPAC2-(2-methylpropylidene)-1,3-oxazolidine
SMILESCC(C)C=C1NCCO1
InChIInChI=1S/C7H13NO/c1-6(2)5-7-8-3-4-9-7/h5-6,8H,3-4H2,1-2H3
InChIKeyASKMAWUNIGTQCH-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.10
Rot. Bonds1

About 2-(2-methylpropylidene)-1,3-oxazolidine

2-(2-methylpropylidene)-1,3-oxazolidine (PubChem CID 174399163) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2-(2-methylpropylidene)-1,3-oxazolidine.

Molecular Properties

Compound Name2-(2-methylpropylidene)-1,3-oxazolidine
PubChem CID174399163
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2-(2-methylpropylidene)-1,3-oxazolidine
SMILESCC(C)C=C1NCCO1
InChIInChI=1S/C7H13NO/c1-6(2)5-7-8-3-4-9-7/h5-6,8H,3-4H2,1-2H3
InChIKeyASKMAWUNIGTQCH-UHFFFAOYSA-N
XLogP1.10
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-Propan-2-ylidene-1,3-oxazolidine
CID 21653841
(2E)-2-ethylidene-1,3-oxazolidine
CID 23189281
2-Ethylidene-1,3-oxazolidine
CID 68559195
2-Butan-2-ylidene-1,3-oxazolidine
CID 143711028
2-Methylidene-1,3-oxazolidine;propane
CID 153632390
2-Ethylidene-4-methyl-1,3-oxazolidine
CID 174050665
2-Pentylidene-1,3-oxazolidine
CID 174633347
2-Butylidene-1,3-oxazolidine
CID 174846474
2-Ethylidene-5-methyl-1,3-oxazolidine
CID 174906636
2-Propylidene-1,3-oxazolidine
CID 175133534

Frequently Asked Questions

What is the IUPAC name of 2-(2-methylpropylidene)-1,3-oxazolidine?
The IUPAC name of 2-(2-methylpropylidene)-1,3-oxazolidine (CID 174399163) is 2-(2-methylpropylidene)-1,3-oxazolidine.
What is the SMILES notation for 2-(2-methylpropylidene)-1,3-oxazolidine?
The canonical SMILES for 2-(2-methylpropylidene)-1,3-oxazolidine is CC(C)C=C1NCCO1.
What is the InChIKey of 2-(2-methylpropylidene)-1,3-oxazolidine?
The InChIKey is ASKMAWUNIGTQCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-6(2)5-7-8-3-4-9-7/h5-6,8H,3-4H2,1-2H3.
What are the key properties of 2-(2-methylpropylidene)-1,3-oxazolidine?
2-(2-methylpropylidene)-1,3-oxazolidine has a molecular weight of 127.19 g/mol, XLogP of 1.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylpropylidene)-1,3-oxazolidine is sourced from PubChem (CID 174399163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).