2,2-bis(2-methylpropyl)-1,3-oxazolidine

C11H23NO — CID 174432981

IUPAC2,2-bis(2-methylpropyl)-1,3-oxazolidine
SMILESCC(C)CC1(CC(C)C)NCCO1
InChIInChI=1S/C11H23NO/c1-9(2)7-11(8-10(3)4)12-5-6-13-11/h9-10,12H,5-8H2,1-4H3
InChIKeyQDXHUNVCNLDWKG-UHFFFAOYSA-N
MW185.31 g/mol
LogP2.39
Rot. Bonds4

About 2,2-bis(2-methylpropyl)-1,3-oxazolidine

2,2-bis(2-methylpropyl)-1,3-oxazolidine (PubChem CID 174432981) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 2,2-bis(2-methylpropyl)-1,3-oxazolidine.

Molecular Properties

Compound Name2,2-bis(2-methylpropyl)-1,3-oxazolidine
PubChem CID174432981
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name2,2-bis(2-methylpropyl)-1,3-oxazolidine
SMILESCC(C)CC1(CC(C)C)NCCO1
InChIInChI=1S/C11H23NO/c1-9(2)7-11(8-10(3)4)12-5-6-13-11/h9-10,12H,5-8H2,1-4H3
InChIKeyQDXHUNVCNLDWKG-UHFFFAOYSA-N
XLogP2.39
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-bis(2-methylpropyl)-1,3-oxazolidine?
The IUPAC name of 2,2-bis(2-methylpropyl)-1,3-oxazolidine (CID 174432981) is 2,2-bis(2-methylpropyl)-1,3-oxazolidine.
What is the SMILES notation for 2,2-bis(2-methylpropyl)-1,3-oxazolidine?
The canonical SMILES for 2,2-bis(2-methylpropyl)-1,3-oxazolidine is CC(C)CC1(CC(C)C)NCCO1.
What is the InChIKey of 2,2-bis(2-methylpropyl)-1,3-oxazolidine?
The InChIKey is QDXHUNVCNLDWKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-9(2)7-11(8-10(3)4)12-5-6-13-11/h9-10,12H,5-8H2,1-4H3.
What are the key properties of 2,2-bis(2-methylpropyl)-1,3-oxazolidine?
2,2-bis(2-methylpropyl)-1,3-oxazolidine has a molecular weight of 185.31 g/mol, XLogP of 2.39, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-bis(2-methylpropyl)-1,3-oxazolidine is sourced from PubChem (CID 174432981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).