7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride

C7H16Cl2N2 — CID 11989221

IUPAC7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride
SMILESCC1(N)CNCC12CC2.Cl.Cl
InChIInChI=1S/C7H14N2.2ClH/c1-6(8)4-9-5-7(6)2-3-7;;/h9H,2-5,8H2,1H3;2*1H
InChIKeyBVLDJMARULEEGX-UHFFFAOYSA-N
MW199.12 g/mol
LogP0.93
Rot. Bonds

About 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride

7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride (PubChem CID 11989221) has the molecular formula C7H16Cl2N2 and a molecular weight of 199.12 g/mol. Its IUPAC name is 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride.

Molecular Properties

Compound Name7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride
PubChem CID11989221
Molecular FormulaC7H16Cl2N2
Molecular Weight199.12 g/mol
Exact Mass198.07
IUPAC Name7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride
SMILESCC1(N)CNCC12CC2.Cl.Cl
InChIInChI=1S/C7H14N2.2ClH/c1-6(8)4-9-5-7(6)2-3-7;;/h9H,2-5,8H2,1H3;2*1H
InChIKeyBVLDJMARULEEGX-UHFFFAOYSA-N
XLogP0.93
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.12
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
The IUPAC name of 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride (CID 11989221) is 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride.
What is the SMILES notation for 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
The canonical SMILES for 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride is CC1(N)CNCC12CC2.Cl.Cl.
What is the InChIKey of 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
The InChIKey is BVLDJMARULEEGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.2ClH/c1-6(8)4-9-5-7(6)2-3-7;;/h9H,2-5,8H2,1H3;2*1H.
What are the key properties of 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride?
7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride has a molecular weight of 199.12 g/mol, XLogP of 0.93, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-5-azaspiro[2.4]heptan-7-amine;dihydrochloride is sourced from PubChem (CID 11989221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).