4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine

C13H25NO2 — CID 58873378

IUPAC4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(OCC2(C)COC2)CC1
InChIInChI=1S/C13H25NO2/c1-11(2)14-6-4-12(5-7-14)16-10-13(3)8-15-9-13/h11-12H,4-10H2,1-3H3
InChIKeyGLQDBDHSDQIFLT-UHFFFAOYSA-N
MW227.35 g/mol
LogP1.91
Rot. Bonds4

About 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine

4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine (PubChem CID 58873378) has the molecular formula C13H25NO2 and a molecular weight of 227.35 g/mol. Its IUPAC name is 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine.

Molecular Properties

Compound Name4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine
PubChem CID58873378
Molecular FormulaC13H25NO2
Molecular Weight227.35 g/mol
Exact Mass227.19
IUPAC Name4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine
SMILESCC(C)N1CCC(OCC2(C)COC2)CC1
InChIInChI=1S/C13H25NO2/c1-11(2)14-6-4-12(5-7-14)16-10-13(3)8-15-9-13/h11-12H,4-10H2,1-3H3
InChIKeyGLQDBDHSDQIFLT-UHFFFAOYSA-N
XLogP1.91
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 51.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-propan-2-yl-2-(1-propan-2-ylpiperidin-4-yl)oxyacetamide
CID 172511111
1-propan-2-yl-4-[2-[2-[2-[2-[2-(2-propoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]piperidine
CID 174243308
(3aR,6aS)-2-[(3-methyloxetan-3-yl)methyl]-5-propan-2-yl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole
CID 146201415
4-ethoxy-1-[(1-propan-2-ylpiperidin-4-yl)methyl]piperidine
CID 171070473
1-ethyl-4-[2-(1-propan-2-ylpiperidin-4-yl)oxyethyl]piperazine
CID 155702560
7-[2-methyl-4-(1-propan-2-ylpyrrolidin-3-yl)oxybutan-2-yl]-2-oxa-7-azaspiro[3.4]octane
CID 170012192
3-chloro-4-(4-propan-2-ylpiperazin-1-yl)-1,2,5-thiadiazole;4-[(3-methyloxetan-3-yl)methoxymethyl]-1-propan-2-ylpiperidine;4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine;3-methyl-5-(1-propan-2-ylpiperidin-4-yl)-4,5-dihydro-1,2-oxazole;2-propan-2-yl-1,3-dihydroisoindole;2-(4-propan-2-ylpiperazin-1-yl)-1,3-thiazole
CID 159435901
(3-methyloxetan-3-yl)methyl (2R)-3-methyl-2-piperidin-1-ylbutanoate
CID 97318972
2,4,4-trimethyl-2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazolidine;hydrochloride
CID 117227807
1-propan-2-yl-4-(1-propan-2-ylpiperidin-4-yl)piperidine
CID 59059970
4-[2-(1-propan-2-ylpiperidin-4-yl)oxypropan-2-yl]morpholine
CID 146947898
N-(2-cyclopentyloxyethyl)-1-propan-2-ylpiperidin-4-amine
CID 63823696

Frequently Asked Questions

What is the IUPAC name of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
The IUPAC name of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine (CID 58873378) is 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine.
What is the SMILES notation for 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
The canonical SMILES for 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine is CC(C)N1CCC(OCC2(C)COC2)CC1.
What is the InChIKey of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
The InChIKey is GLQDBDHSDQIFLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO2/c1-11(2)14-6-4-12(5-7-14)16-10-13(3)8-15-9-13/h11-12H,4-10H2,1-3H3.
What are the key properties of 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine?
4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine has a molecular weight of 227.35 g/mol, XLogP of 1.91, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-methyloxetan-3-yl)methoxy]-1-propan-2-ylpiperidine is sourced from PubChem (CID 58873378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).