(2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine

C10H19NO — CID 171414290

IUPAC(2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine
SMILESC[C@@H]1CC(C2COC2)CCN1C
InChIInChI=1S/C10H19NO/c1-8-5-9(3-4-11(8)2)10-6-12-7-10/h8-10H,3-7H2,1-2H3/t8-,9?/m1/s1
InChIKeyNEKXNRQHGDOIPU-VEDVMXKPSA-N
MW169.27 g/mol
LogP1.36
Rot. Bonds1

About (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine

(2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine (PubChem CID 171414290) has the molecular formula C10H19NO and a molecular weight of 169.27 g/mol. Its IUPAC name is (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine.

Molecular Properties

Compound Name(2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine
PubChem CID171414290
Molecular FormulaC10H19NO
Molecular Weight169.27 g/mol
Exact Mass169.15
IUPAC Name(2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine
SMILESC[C@@H]1CC(C2COC2)CCN1C
InChIInChI=1S/C10H19NO/c1-8-5-9(3-4-11(8)2)10-6-12-7-10/h8-10H,3-7H2,1-2H3/t8-,9?/m1/s1
InChIKeyNEKXNRQHGDOIPU-VEDVMXKPSA-N
XLogP1.36
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.27
LogP ≤ 51.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-4-cyclobutyl-1,2-dimethylpiperidine
CID 171414314
(2R,3aR,6aS)-1,2-dimethyl-2,3,3a,4,6,6a-hexahydrofuro[3,4-b]pyrrole;ethane
CID 144826290
(2R)-4-iodo-1,2-dimethylpiperidine
CID 177325469
(2R,4S)-N,1,2-trimethylpiperidin-4-amine
CID 94244018
(7R)-3,4,7-trimethyl-1,4-oxazepane
CID 174071951
(2S,4R)-N,1,2-trimethylpiperidin-4-amine
CID 94244017
ethane;N,1,2-trimethylpiperidin-4-amine
CID 178011529
3,4-dimethylmorpholine;ethane;4-methylmorpholine
CID 145315669
(1,2-dimethylpiperidin-4-yl)hydrazine
CID 55281806
1-iodo-2-methyl-2,3,3a,4,6,6a-hexahydrofuro[3,4-b]pyrrole
CID 139403608
9-methyl-3-oxabicyclo[3.3.1]nonane
CID 90743845
1,2-dimethylpyrrolidine;methanol
CID 158560912

Frequently Asked Questions

What is the IUPAC name of (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine?
The IUPAC name of (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine (CID 171414290) is (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine.
What is the SMILES notation for (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine?
The canonical SMILES for (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine is C[C@@H]1CC(C2COC2)CCN1C.
What is the InChIKey of (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine?
The InChIKey is NEKXNRQHGDOIPU-VEDVMXKPSA-N. The full InChI is InChI=1S/C10H19NO/c1-8-5-9(3-4-11(8)2)10-6-12-7-10/h8-10H,3-7H2,1-2H3/t8-,9?/m1/s1.
What are the key properties of (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine?
(2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine has a molecular weight of 169.27 g/mol, XLogP of 1.36, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1,2-dimethyl-4-(oxetan-3-yl)piperidine is sourced from PubChem (CID 171414290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).