1-[2-(3-methylcyclobutyl)oxyethyl]piperidine

C12H23NO — CID 167531416

IUPAC1-[2-(3-methylcyclobutyl)oxyethyl]piperidine
SMILESCC1CC(OCCN2CCCCC2)C1
InChIInChI=1S/C12H23NO/c1-11-9-12(10-11)14-8-7-13-5-3-2-4-6-13/h11-12H,2-10H2,1H3
InChIKeyWFZCIBRNCCTLMG-UHFFFAOYSA-N
MW197.32 g/mol
LogP2.29
Rot. Bonds4

About 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine

1-[2-(3-methylcyclobutyl)oxyethyl]piperidine (PubChem CID 167531416) has the molecular formula C12H23NO and a molecular weight of 197.32 g/mol. Its IUPAC name is 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine.

Molecular Properties

Compound Name1-[2-(3-methylcyclobutyl)oxyethyl]piperidine
PubChem CID167531416
Molecular FormulaC12H23NO
Molecular Weight197.32 g/mol
Exact Mass197.18
IUPAC Name1-[2-(3-methylcyclobutyl)oxyethyl]piperidine
SMILESCC1CC(OCCN2CCCCC2)C1
InChIInChI=1S/C12H23NO/c1-11-9-12(10-11)14-8-7-13-5-3-2-4-6-13/h11-12H,2-10H2,1H3
InChIKeyWFZCIBRNCCTLMG-UHFFFAOYSA-N
XLogP2.29
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.32
LogP ≤ 52.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[3-(3-methylcyclobutyl)oxypropyl]piperidine
CID 167608306
3-(2-piperidin-1-ylethoxy)cyclopentan-1-amine
CID 79459282
3-(2-piperidin-1-ylethoxy)cyclohexan-1-amine
CID 79465695
1-(2-ethoxyethyl)piperidine
CID 22622871
1-(2-methoxyethyl)azocane
CID 47014834
ethane;1-[2-(3-methoxycyclobutyl)oxyethyl]-4-methylpiperazine
CID 155583779
1-(2-cyclohexyloxyethyl)-1,5-diazocane
CID 63826545
1-(2-cyclopentyloxyethyl)-4-methyl-1,5-diazocane
CID 63826366
1-[2-(1,4-dioxaspiro[4.5]decan-8-yloxy)ethyl]piperidine
CID 113414152
1-(2-cyclohexyloxyethyl)-N-methylpiperidin-4-amine
CID 63827361
1-(2-cyclobutyloxyethyl)-4-ethylpiperazine
CID 142616194
1-[(3-methylcyclobutyl)methyl]piperidine
CID 120999950

Frequently Asked Questions

What is the IUPAC name of 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine?
The IUPAC name of 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine (CID 167531416) is 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine.
What is the SMILES notation for 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine?
The canonical SMILES for 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine is CC1CC(OCCN2CCCCC2)C1.
What is the InChIKey of 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine?
The InChIKey is WFZCIBRNCCTLMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO/c1-11-9-12(10-11)14-8-7-13-5-3-2-4-6-13/h11-12H,2-10H2,1H3.
What are the key properties of 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine?
1-[2-(3-methylcyclobutyl)oxyethyl]piperidine has a molecular weight of 197.32 g/mol, XLogP of 2.29, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methylcyclobutyl)oxyethyl]piperidine is sourced from PubChem (CID 167531416), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).