4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine

C20H38N2O2 — CID 158335840

IUPAC4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine
SMILESCC(C)(C)OC1CC(OC2CCN(CCN3CCCCC3)CC2)C1
InChIInChI=1S/C20H38N2O2/c1-20(2,3)24-19-15-18(16-19)23-17-7-11-22(12-8-17)14-13-21-9-5-4-6-10-21/h17-19H,4-16H2,1-3H3
InChIKeyRQKACHICGFSIST-UHFFFAOYSA-N
MW338.54 g/mol
LogP3.30
Rot. Bonds6

About 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine

4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine (PubChem CID 158335840) has the molecular formula C20H38N2O2 and a molecular weight of 338.54 g/mol. Its IUPAC name is 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine.

Molecular Properties

Compound Name4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine
PubChem CID158335840
Molecular FormulaC20H38N2O2
Molecular Weight338.54 g/mol
Exact Mass338.29
IUPAC Name4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine
SMILESCC(C)(C)OC1CC(OC2CCN(CCN3CCCCC3)CC2)C1
InChIInChI=1S/C20H38N2O2/c1-20(2,3)24-19-15-18(16-19)23-17-7-11-22(12-8-17)14-13-21-9-5-4-6-10-21/h17-19H,4-16H2,1-3H3
InChIKeyRQKACHICGFSIST-UHFFFAOYSA-N
XLogP3.30
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.54
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine with MolForge

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Related Compounds

1-tert-butyl-4-[[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]methyl]piperazine
CID 153436977
4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-[6-[(2-methylpropan-2-yl)oxy]hex-4-ynyl]piperidine
CID 134488993
1-tert-butyl-4-[(1R,3S)-3-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxypiperidine
CID 146549005
ethane;1-[2-[4-(3-methoxycyclobutyl)oxypiperidin-1-yl]ethyl]-4-methylpiperazine;methoxymethane;propane
CID 142368331
1-[1-[2,4-dimethyl-4-[6-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]hex-2-ynoxy]pentan-2-yl]azetidin-3-yl]oxy-4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine
CID 154957378
1-ethyl-3-[(2-methylpropan-2-yl)oxy]pyrrolidine
CID 58721733
1-tert-butyl-4-[4-[[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]methyl]imidazol-1-yl]piperidine
CID 153320478
ethane;N-methyl-6-[4-[(2-methylpropan-2-yl)oxy]piperidin-1-yl]hexan-1-amine
CID 165146040
[1-[2,4-dimethyl-4-[6-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]hex-2-ynoxy]pentan-2-yl]azetidin-3-yl] 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidine-1-carboxylate
CID 146331920
1-[3-(3-methylazetidin-1-yl)propyl]-4-(3-methylcyclobutyl)oxypiperidine
CID 167594175
4-(1-tert-butylazetidin-3-yl)-1-[4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxypiperidin-1-yl]butan-1-one
CID 140908004
1-(2,2-dimethylpropyl)-4-[1-(3-methylbutyl)piperidin-4-yl]oxypiperidine
CID 165372771

Frequently Asked Questions

What is the IUPAC name of 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine?
The IUPAC name of 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine (CID 158335840) is 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine.
What is the SMILES notation for 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine?
The canonical SMILES for 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine is CC(C)(C)OC1CC(OC2CCN(CCN3CCCCC3)CC2)C1.
What is the InChIKey of 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine?
The InChIKey is RQKACHICGFSIST-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38N2O2/c1-20(2,3)24-19-15-18(16-19)23-17-7-11-22(12-8-17)14-13-21-9-5-4-6-10-21/h17-19H,4-16H2,1-3H3.
What are the key properties of 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine?
4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine has a molecular weight of 338.54 g/mol, XLogP of 3.30, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[(2-methylpropan-2-yl)oxy]cyclobutyl]oxy-1-(2-piperidin-1-ylethyl)piperidine is sourced from PubChem (CID 158335840), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).