2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine

C9H19NO — CID 13086258

IUPAC2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine
SMILESCCC1OCC(C(C)C)N1C
InChIInChI=1S/C9H19NO/c1-5-9-10(4)8(6-11-9)7(2)3/h7-9H,5-6H2,1-4H3
InChIKeyFSQIONHPUIWYAW-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.71
Rot. Bonds2

About 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine

2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine (PubChem CID 13086258) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine.

Molecular Properties

Compound Name2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine
PubChem CID13086258
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC Name2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine
SMILESCCC1OCC(C(C)C)N1C
InChIInChI=1S/C9H19NO/c1-5-9-10(4)8(6-11-9)7(2)3/h7-9H,5-6H2,1-4H3
InChIKeyFSQIONHPUIWYAW-UHFFFAOYSA-N
XLogP1.71
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine?
The IUPAC name of 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine (CID 13086258) is 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine.
What is the SMILES notation for 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine?
The canonical SMILES for 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine is CCC1OCC(C(C)C)N1C.
What is the InChIKey of 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine?
The InChIKey is FSQIONHPUIWYAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-9-10(4)8(6-11-9)7(2)3/h7-9H,5-6H2,1-4H3.
What are the key properties of 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine?
2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine has a molecular weight of 157.26 g/mol, XLogP of 1.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-methyl-4-propan-2-yl-1,3-oxazolidine is sourced from PubChem (CID 13086258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).