2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine

C9H17NO — CID 117228568

IUPAC2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine
SMILESCC1(C)COC(C2CCC2)N1
InChIInChI=1S/C9H17NO/c1-9(2)6-11-8(10-9)7-4-3-5-7/h7-8,10H,3-6H2,1-2H3
InChIKeyWCUPGHNENYFVFR-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.51
Rot. Bonds1

About 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine

2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine (PubChem CID 117228568) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine.

Molecular Properties

Compound Name2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine
PubChem CID117228568
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine
SMILESCC1(C)COC(C2CCC2)N1
InChIInChI=1S/C9H17NO/c1-9(2)6-11-8(10-9)7-4-3-5-7/h7-8,10H,3-6H2,1-2H3
InChIKeyWCUPGHNENYFVFR-UHFFFAOYSA-N
XLogP1.51
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(4aS,8aR)-3,3,7,7-tetramethyl-2,4,4a,6,8,8a-hexahydro-[1,4]oxazino[3,2-b][1,4]oxazine
CID 139225414
(2R)-2-[(2S)-4,4-dimethyl-1,3-oxazolidin-2-yl]-4,4-dimethyl-1,3-oxazolidine
CID 139225415
4,4-dimethyl-2-(1-propan-2-ylpiperidin-3-yl)-1,3-oxazolidine;hydrochloride
CID 117227855
2-cyclobutyl-5,5-dimethyl-1,3-oxazinane
CID 117227173
2-cyclobutyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117227172
4,4-dimethyl-2-(thiolan-3-yl)-1,3-oxazolidine;hydrochloride
CID 117227603
4,4-dimethyl-2-(thian-2-yl)-1,3-oxazolidine
CID 117227940
2-(4,4-dimethyl-1,3-oxazolidin-2-yl)thiolane 1,1-dioxide
CID 117227876
2-cyclohexyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117227188
(4aR,7aS)-3,3-dimethyl-4,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazine
CID 51863688
4,4-dimethyl-2-(1-propan-2-ylpyrrolidin-2-yl)-1,3-oxazolidine;hydrochloride
CID 117227911
3,3-dimethyl-2,4,4a,5,6,7,8,8a-octahydrobenzo[b][1,4]oxazine
CID 43366931

Frequently Asked Questions

What is the IUPAC name of 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine?
The IUPAC name of 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine (CID 117228568) is 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine.
What is the SMILES notation for 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine?
The canonical SMILES for 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine is CC1(C)COC(C2CCC2)N1.
What is the InChIKey of 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine?
The InChIKey is WCUPGHNENYFVFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-9(2)6-11-8(10-9)7-4-3-5-7/h7-8,10H,3-6H2,1-2H3.
What are the key properties of 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine?
2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine has a molecular weight of 155.24 g/mol, XLogP of 1.51, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclobutyl-4,4-dimethyl-1,3-oxazolidine is sourced from PubChem (CID 117228568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).