2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride

C7H16Cl2N2 — CID 138106147

IUPAC2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride
SMILESCN1CC2(CC(N)C2)C1.Cl.Cl
InChIInChI=1S/C7H14N2.2ClH/c1-9-4-7(5-9)2-6(8)3-7;;/h6H,2-5,8H2,1H3;2*1H
InChIKeyWAFDVVXCCJNCED-UHFFFAOYSA-N
MW199.12 g/mol
LogP0.88
Rot. Bonds

About 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride

2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride (PubChem CID 138106147) has the molecular formula C7H16Cl2N2 and a molecular weight of 199.12 g/mol. Its IUPAC name is 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride.

Molecular Properties

Compound Name2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride
PubChem CID138106147
Molecular FormulaC7H16Cl2N2
Molecular Weight199.12 g/mol
Exact Mass198.07
IUPAC Name2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride
SMILESCN1CC2(CC(N)C2)C1.Cl.Cl
InChIInChI=1S/C7H14N2.2ClH/c1-9-4-7(5-9)2-6(8)3-7;;/h6H,2-5,8H2,1H3;2*1H
InChIKeyWAFDVVXCCJNCED-UHFFFAOYSA-N
XLogP0.88
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.12
LogP ≤ 50.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride?
The IUPAC name of 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride (CID 138106147) is 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride.
What is the SMILES notation for 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride?
The canonical SMILES for 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride is CN1CC2(CC(N)C2)C1.Cl.Cl.
What is the InChIKey of 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride?
The InChIKey is WAFDVVXCCJNCED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.2ClH/c1-9-4-7(5-9)2-6(8)3-7;;/h6H,2-5,8H2,1H3;2*1H.
What are the key properties of 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride?
2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride has a molecular weight of 199.12 g/mol, XLogP of 0.88, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-2-azaspiro[3.3]heptan-6-amine;dihydrochloride is sourced from PubChem (CID 138106147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).