5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine

C11H22N2O — CID 117228935

IUPAC5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine
SMILESCC1(C)CNC(CC2CCCNC2)O1
InChIInChI=1S/C11H22N2O/c1-11(2)8-13-10(14-11)6-9-4-3-5-12-7-9/h9-10,12-13H,3-8H2,1-2H3
InChIKeyZLQPJOAQACFIFP-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.10
Rot. Bonds2

About 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine

5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine (PubChem CID 117228935) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine.

Molecular Properties

Compound Name5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine
PubChem CID117228935
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine
SMILESCC1(C)CNC(CC2CCCNC2)O1
InChIInChI=1S/C11H22N2O/c1-11(2)8-13-10(14-11)6-9-4-3-5-12-7-9/h9-10,12-13H,3-8H2,1-2H3
InChIKeyZLQPJOAQACFIFP-UHFFFAOYSA-N
XLogP1.10
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(5,5-dimethyl-1,3-oxazolidin-2-yl)methyl]thiane 1,1-dioxide
CID 117228758
(3R)-3-(cyclopentylmethyl)piperidine
CID 94379259
3-(oxolan-3-ylmethyl)piperidine
CID 63563820
4,4-dimethyl-2-(pyrrolidin-3-ylmethyl)-1,3-oxazolidine;hydrochloride
CID 117227725
N-[(5,5-dimethyloxolan-2-yl)methyl]-N-(piperidin-3-ylmethyl)cyclopropanamine
CID 106640288
3-[(1-methylpyrrolidin-2-yl)methyl]piperidine
CID 82601495
[6,6-dimethyl-4-(piperidin-3-ylmethyl)morpholin-2-yl]methanol
CID 114782619
3-(2,2-dimethylpropyl)piperidine
CID 21041533
3-[(4-methoxycyclohexyl)methyl]piperidine
CID 84734618
3-[(3,3-dimethylazetidin-1-yl)methyl]piperidine
CID 79678705
[2-methyl-2-(piperidin-3-ylmethyl)-1,3-dioxolan-4-yl]methanol
CID 117169312
3-[[(4S)-4-methyloxan-2-yl]methyl]piperidine
CID 138580415

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine?
The IUPAC name of 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine (CID 117228935) is 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine.
What is the SMILES notation for 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine?
The canonical SMILES for 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine is CC1(C)CNC(CC2CCCNC2)O1.
What is the InChIKey of 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine?
The InChIKey is ZLQPJOAQACFIFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-11(2)8-13-10(14-11)6-9-4-3-5-12-7-9/h9-10,12-13H,3-8H2,1-2H3.
What are the key properties of 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine?
5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine has a molecular weight of 198.31 g/mol, XLogP of 1.10, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-2-(piperidin-3-ylmethyl)-1,3-oxazolidine is sourced from PubChem (CID 117228935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).