2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane

C12H22N2 — CID 170601553

IUPAC2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane
SMILESC1CC2(C1)CNC2.C1CC2(CC2)CN1
InChIInChI=1S/2C6H11N/c1-2-6(1)3-4-7-5-6;1-2-6(3-1)4-7-5-6/h2*7H,1-5H2
InChIKeyHNSBWBQNKHPDNV-UHFFFAOYSA-N
MW194.32 g/mol
LogP1.52
Rot. Bonds

About 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane

2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane (PubChem CID 170601553) has the molecular formula C12H22N2 and a molecular weight of 194.32 g/mol. Its IUPAC name is 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane.

Molecular Properties

Compound Name2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane
PubChem CID170601553
Molecular FormulaC12H22N2
Molecular Weight194.32 g/mol
Exact Mass194.18
IUPAC Name2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane
SMILESC1CC2(C1)CNC2.C1CC2(CC2)CN1
InChIInChI=1S/2C6H11N/c1-2-6(1)3-4-7-5-6;1-2-6(3-1)4-7-5-6/h2*7H,1-5H2
InChIKeyHNSBWBQNKHPDNV-UHFFFAOYSA-N
XLogP1.52
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(5R)-2,9-diazaspiro[4.5]decane
CID 86326439
2-azaspiro[3.3]heptane
CID 20521856
2,9-diazaspiro[4.5]decane;methane
CID 143578856
2-azaspiro[4.5]decane;ethene
CID 171834081
7-azaspiro[4.6]undecane
CID 75488634
11-azadispiro[4.2.58.25]pentadecane
CID 114820262
2,7-diazaspiro[3.4]octane;ethane
CID 171068778
2,8-diazaspiro[4.5]decane;ethane
CID 143048064
7-azaspiro[4.6]undecane;hydrochloride
CID 138039788
12-azadispiro[3.1.46.34]tridecane
CID 130118799
2,7-diazaspiro[3.4]octane;ethane
CID 143687523
6-azaspiro[3.4]octane;2,2,2-trifluoroacetic acid
CID 90185681

Frequently Asked Questions

What is the IUPAC name of 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane?
The IUPAC name of 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane (CID 170601553) is 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane.
What is the SMILES notation for 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane?
The canonical SMILES for 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane is C1CC2(C1)CNC2.C1CC2(CC2)CN1.
What is the InChIKey of 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane?
The InChIKey is HNSBWBQNKHPDNV-UHFFFAOYSA-N. The full InChI is InChI=1S/2C6H11N/c1-2-6(1)3-4-7-5-6;1-2-6(3-1)4-7-5-6/h2*7H,1-5H2.
What are the key properties of 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane?
2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane has a molecular weight of 194.32 g/mol, XLogP of 1.52, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-azaspiro[3.3]heptane;5-azaspiro[2.4]heptane is sourced from PubChem (CID 170601553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).