6-propyl-2,6-diazaspiro[3.4]octane

C9H18N2 — CID 15107458

IUPAC6-propyl-2,6-diazaspiro[3.4]octane
SMILESCCCN1CCC2(CNC2)C1
InChIInChI=1S/C9H18N2/c1-2-4-11-5-3-9(8-11)6-10-7-9/h10H,2-8H2,1H3
InChIKeySNMFICALXQLGDB-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.69
Rot. Bonds2

About 6-propyl-2,6-diazaspiro[3.4]octane

6-propyl-2,6-diazaspiro[3.4]octane (PubChem CID 15107458) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 6-propyl-2,6-diazaspiro[3.4]octane.

Molecular Properties

Compound Name6-propyl-2,6-diazaspiro[3.4]octane
PubChem CID15107458
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name6-propyl-2,6-diazaspiro[3.4]octane
SMILESCCCN1CCC2(CNC2)C1
InChIInChI=1S/C9H18N2/c1-2-4-11-5-3-9(8-11)6-10-7-9/h10H,2-8H2,1H3
InChIKeySNMFICALXQLGDB-UHFFFAOYSA-N
XLogP0.69
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-propyl-2,6-diazaspiro[3.4]octane?
The IUPAC name of 6-propyl-2,6-diazaspiro[3.4]octane (CID 15107458) is 6-propyl-2,6-diazaspiro[3.4]octane.
What is the SMILES notation for 6-propyl-2,6-diazaspiro[3.4]octane?
The canonical SMILES for 6-propyl-2,6-diazaspiro[3.4]octane is CCCN1CCC2(CNC2)C1.
What is the InChIKey of 6-propyl-2,6-diazaspiro[3.4]octane?
The InChIKey is SNMFICALXQLGDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-2-4-11-5-3-9(8-11)6-10-7-9/h10H,2-8H2,1H3.
What are the key properties of 6-propyl-2,6-diazaspiro[3.4]octane?
6-propyl-2,6-diazaspiro[3.4]octane has a molecular weight of 154.26 g/mol, XLogP of 0.69, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propyl-2,6-diazaspiro[3.4]octane is sourced from PubChem (CID 15107458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).