4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine

C9H18N2O2 — CID 118865764

IUPAC4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine
SMILESCC1COCN1CN1COCC1C
InChIInChI=1S/C9H18N2O2/c1-8-3-12-6-10(8)5-11-7-13-4-9(11)2/h8-9H,3-7H2,1-2H3
InChIKeyDXOGYGZNVYEDBP-UHFFFAOYSA-N
MW186.25 g/mol
LogP0.30
Rot. Bonds2

About 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine

4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine (PubChem CID 118865764) has the molecular formula C9H18N2O2 and a molecular weight of 186.25 g/mol. Its IUPAC name is 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine.

Molecular Properties

Compound Name4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine
PubChem CID118865764
Molecular FormulaC9H18N2O2
Molecular Weight186.25 g/mol
Exact Mass186.14
IUPAC Name4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine
SMILESCC1COCN1CN1COCC1C
InChIInChI=1S/C9H18N2O2/c1-8-3-12-6-10(8)5-11-7-13-4-9(11)2/h8-9H,3-7H2,1-2H3
InChIKeyDXOGYGZNVYEDBP-UHFFFAOYSA-N
XLogP0.30
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 50.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine?
The IUPAC name of 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine (CID 118865764) is 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine.
What is the SMILES notation for 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine?
The canonical SMILES for 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine is CC1COCN1CN1COCC1C.
What is the InChIKey of 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine?
The InChIKey is DXOGYGZNVYEDBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O2/c1-8-3-12-6-10(8)5-11-7-13-4-9(11)2/h8-9H,3-7H2,1-2H3.
What are the key properties of 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine?
4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine has a molecular weight of 186.25 g/mol, XLogP of 0.30, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-3-[(4-methyl-1,3-oxazolidin-3-yl)methyl]-1,3-oxazolidine is sourced from PubChem (CID 118865764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).