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

C13H24N2O — CID 167217780

IUPAC2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane
SMILESCOC1CC(N2CCC3(CCNCC3)C2)C1
InChIInChI=1S/C13H24N2O/c1-16-12-8-11(9-12)15-7-4-13(10-15)2-5-14-6-3-13/h11-12,14H,2-10H2,1H3
InChIKeyDHOVVIDBNDNAOY-UHFFFAOYSA-N
MW224.35 g/mol
LogP1.24
Rot. Bonds2

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

2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane (PubChem CID 167217780) has the molecular formula C13H24N2O and a molecular weight of 224.35 g/mol. Its IUPAC name is 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane.

Molecular Properties

Compound Name2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane
PubChem CID167217780
Molecular FormulaC13H24N2O
Molecular Weight224.35 g/mol
Exact Mass224.19
IUPAC Name2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane
SMILESCOC1CC(N2CCC3(CCNCC3)C2)C1
InChIInChI=1S/C13H24N2O/c1-16-12-8-11(9-12)15-7-4-13(10-15)2-5-14-6-3-13/h11-12,14H,2-10H2,1H3
InChIKeyDHOVVIDBNDNAOY-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 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
The IUPAC name of 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane (CID 167217780) is 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane.
What is the SMILES notation for 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
The canonical SMILES for 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane is COC1CC(N2CCC3(CCNCC3)C2)C1.
What is the InChIKey of 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
The InChIKey is DHOVVIDBNDNAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24N2O/c1-16-12-8-11(9-12)15-7-4-13(10-15)2-5-14-6-3-13/h11-12,14H,2-10H2,1H3.
What are the key properties of 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane?
2-(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 2-(3-methoxycyclobutyl)-2,8-diazaspiro[4.5]decane is sourced from PubChem (CID 167217780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).