8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane

C13H24N2O — CID 167217778

IUPAC8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane
SMILESCOC1CC(N2CCC3(CCNC3)CC2)C1
InChIInChI=1S/C13H24N2O/c1-16-12-8-11(9-12)15-6-3-13(4-7-15)2-5-14-10-13/h11-12,14H,2-10H2,1H3
InChIKeyGPYBWHWVRYSIKQ-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.24
Rot. Bonds2

About 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane

8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane (PubChem CID 167217778) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane
PubChem CID167217778
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane
SMILESCOC1CC(N2CCC3(CCNC3)CC2)C1
InChIInChI=1S/C13H24N2O/c1-16-12-8-11(9-12)15-6-3-13(4-7-15)2-5-14-10-13/h11-12,14H,2-10H2,1H3
InChIKeyGPYBWHWVRYSIKQ-UHFFFAOYSA-N
XLogP1.24
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
The IUPAC name of 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane (CID 167217778) is 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane is COC1CC(N2CCC3(CCNC3)CC2)C1.
What is the InChIKey of 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
The InChIKey is GPYBWHWVRYSIKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-16-12-8-11(9-12)15-6-3-13(4-7-15)2-5-14-10-13/h11-12,14H,2-10H2,1H3.
What are the key properties of 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane has a molecular weight of 224.35 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 167217778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).