1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine

C15H29NO — CID 177123010

IUPAC1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine
SMILESCC(C)C1CC(OC2CCN(C(C)C)CC2)C1
InChIInChI=1S/C15H29NO/c1-11(2)13-9-15(10-13)17-14-5-7-16(8-6-14)12(3)4/h11-15H,5-10H2,1-4H3
InChIKeyMCARLMYFOPKDBT-UHFFFAOYSA-N
MW239.40 g/mol
LogP3.31
Rot. Bonds4

About 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine

1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine (PubChem CID 177123010) has the molecular formula C15H29NO and a molecular weight of 239.40 g/mol. Its IUPAC name is 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine.

Molecular Properties

Compound Name1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine
PubChem CID177123010
Molecular FormulaC15H29NO
Molecular Weight239.40 g/mol
Exact Mass239.22
IUPAC Name1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine
SMILESCC(C)C1CC(OC2CCN(C(C)C)CC2)C1
InChIInChI=1S/C15H29NO/c1-11(2)13-9-15(10-13)17-14-5-7-16(8-6-14)12(3)4/h11-15H,5-10H2,1-4H3
InChIKeyMCARLMYFOPKDBT-UHFFFAOYSA-N
XLogP3.31
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.40
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine?
The IUPAC name of 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine (CID 177123010) is 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine.
What is the SMILES notation for 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine?
The canonical SMILES for 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine is CC(C)C1CC(OC2CCN(C(C)C)CC2)C1.
What is the InChIKey of 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine?
The InChIKey is MCARLMYFOPKDBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO/c1-11(2)13-9-15(10-13)17-14-5-7-16(8-6-14)12(3)4/h11-15H,5-10H2,1-4H3.
What are the key properties of 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine?
1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine has a molecular weight of 239.40 g/mol, XLogP of 3.31, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-propan-2-yl-4-(3-propan-2-ylcyclobutyl)oxypiperidine is sourced from PubChem (CID 177123010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).