4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane

C18H37NO — CID 163401563

IUPAC4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane
SMILESCC(C)CC1CCC1.COC1CCN(CC(C)C)CC1
InChIInChI=1S/C10H21NO.C8H16/c1-9(2)8-11-6-4-10(12-3)5-7-11;1-7(2)6-8-4-3-5-8/h9-10H,4-8H2,1-3H3;7-8H,3-6H2,1-2H3
InChIKeyWPQOGFIALIKYIX-UHFFFAOYSA-N
MW283.50 g/mol
LogP4.59
Rot. Bonds5

About 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane

4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane (PubChem CID 163401563) has the molecular formula C18H37NO and a molecular weight of 283.50 g/mol. Its IUPAC name is 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane.

Molecular Properties

Compound Name4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane
PubChem CID163401563
Molecular FormulaC18H37NO
Molecular Weight283.50 g/mol
Exact Mass283.29
IUPAC Name4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane
SMILESCC(C)CC1CCC1.COC1CCN(CC(C)C)CC1
InChIInChI=1S/C10H21NO.C8H16/c1-9(2)8-11-6-4-10(12-3)5-7-11;1-7(2)6-8-4-3-5-8/h9-10H,4-8H2,1-3H3;7-8H,3-6H2,1-2H3
InChIKeyWPQOGFIALIKYIX-UHFFFAOYSA-N
XLogP4.59
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.50
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane?
The IUPAC name of 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane (CID 163401563) is 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane.
What is the SMILES notation for 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane?
The canonical SMILES for 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane is CC(C)CC1CCC1.COC1CCN(CC(C)C)CC1.
What is the InChIKey of 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane?
The InChIKey is WPQOGFIALIKYIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO.C8H16/c1-9(2)8-11-6-4-10(12-3)5-7-11;1-7(2)6-8-4-3-5-8/h9-10H,4-8H2,1-3H3;7-8H,3-6H2,1-2H3.
What are the key properties of 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane?
4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane has a molecular weight of 283.50 g/mol, XLogP of 4.59, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-1-(2-methylpropyl)piperidine;2-methylpropylcyclobutane is sourced from PubChem (CID 163401563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).