3,4,5-tri(propan-2-yl)-1,3-oxazolidine

C12H25NO — CID 166020225

IUPAC3,4,5-tri(propan-2-yl)-1,3-oxazolidine
SMILESCC(C)C1OCN(C(C)C)C1C(C)C
InChIInChI=1S/C12H25NO/c1-8(2)11-12(9(3)4)14-7-13(11)10(5)6/h8-12H,7H2,1-6H3
InChIKeyNAHAQIWUCXIKAJ-UHFFFAOYSA-N
MW199.34 g/mol
LogP2.73
Rot. Bonds3

About 3,4,5-tri(propan-2-yl)-1,3-oxazolidine

3,4,5-tri(propan-2-yl)-1,3-oxazolidine (PubChem CID 166020225) has the molecular formula C12H25NO and a molecular weight of 199.34 g/mol. Its IUPAC name is 3,4,5-tri(propan-2-yl)-1,3-oxazolidine.

Molecular Properties

Compound Name3,4,5-tri(propan-2-yl)-1,3-oxazolidine
PubChem CID166020225
Molecular FormulaC12H25NO
Molecular Weight199.34 g/mol
Exact Mass199.19
IUPAC Name3,4,5-tri(propan-2-yl)-1,3-oxazolidine
SMILESCC(C)C1OCN(C(C)C)C1C(C)C
InChIInChI=1S/C12H25NO/c1-8(2)11-12(9(3)4)14-7-13(11)10(5)6/h8-12H,7H2,1-6H3
InChIKeyNAHAQIWUCXIKAJ-UHFFFAOYSA-N
XLogP2.73
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.34
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 3,4,5-tri(propan-2-yl)-1,3-oxazolidine 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

2,3,4-tri(propan-2-yl)morpholine
CID 166020055
2,3,4-tri(propan-2-yl)-1,4-oxazepan-5-one
CID 153310408
(4S,5S)-4,5-di(propan-2-yl)-1,3-dioxolane
CID 23266361
3,4-di(propan-2-yl)-1,3-oxazolidine
CID 58916313
3,4,5-tri(propan-2-yl)-1,3-thiazolidine
CID 166020057
3,4-di(propan-2-yl)-1,3-oxazinane
CID 146614615
(2S,3R)-1,2-di(propan-2-yl)pyrrolidin-3-ol
CID 146572367
(2R)-2,3-di(propan-2-yl)-3-azabicyclo[3.2.0]heptane
CID 166831910
3-(methoxymethyl)-1,2-di(propan-2-yl)pyrrolidine
CID 58778810
(1R,2R,5S)-6,6-dimethyl-2,3-di(propan-2-yl)-3-azabicyclo[3.1.0]hexane
CID 170300237
(2R,3R)-3-methyl-2-propan-2-yloxane
CID 121477252
(2S,3R)-3-methyl-2-propan-2-yloxane
CID 121477247

Frequently Asked Questions

What is the IUPAC name of 3,4,5-tri(propan-2-yl)-1,3-oxazolidine?
The IUPAC name of 3,4,5-tri(propan-2-yl)-1,3-oxazolidine (CID 166020225) is 3,4,5-tri(propan-2-yl)-1,3-oxazolidine.
What is the SMILES notation for 3,4,5-tri(propan-2-yl)-1,3-oxazolidine?
The canonical SMILES for 3,4,5-tri(propan-2-yl)-1,3-oxazolidine is CC(C)C1OCN(C(C)C)C1C(C)C.
What is the InChIKey of 3,4,5-tri(propan-2-yl)-1,3-oxazolidine?
The InChIKey is NAHAQIWUCXIKAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO/c1-8(2)11-12(9(3)4)14-7-13(11)10(5)6/h8-12H,7H2,1-6H3.
What are the key properties of 3,4,5-tri(propan-2-yl)-1,3-oxazolidine?
3,4,5-tri(propan-2-yl)-1,3-oxazolidine has a molecular weight of 199.34 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-tri(propan-2-yl)-1,3-oxazolidine is sourced from PubChem (CID 166020225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).