8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride

C8H18Cl2N2 — CID 2775928

IUPAC8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
SMILESCN1C2CCC1CC(N)C2.Cl.Cl
InChIInChI=1S/C8H16N2.2ClH/c1-10-7-2-3-8(10)5-6(9)4-7;;/h6-8H,2-5,9H2,1H3;2*1H
InChIKeyKVYQKWPZQKGICY-UHFFFAOYSA-N
MW213.15 g/mol
LogP1.41
Rot. Bonds

About 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride

8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride (PubChem CID 2775928) has the molecular formula C8H18Cl2N2 and a molecular weight of 213.15 g/mol. Its IUPAC name is 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride.

Molecular Properties

Compound Name8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
PubChem CID2775928
Molecular FormulaC8H18Cl2N2
Molecular Weight213.15 g/mol
Exact Mass212.08
IUPAC Name8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride
SMILESCN1C2CCC1CC(N)C2.Cl.Cl
InChIInChI=1S/C8H16N2.2ClH/c1-10-7-2-3-8(10)5-6(9)4-7;;/h6-8H,2-5,9H2,1H3;2*1H
InChIKeyKVYQKWPZQKGICY-UHFFFAOYSA-N
XLogP1.41
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.15
LogP ≤ 51.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
The IUPAC name of 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride (CID 2775928) is 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride.
What is the SMILES notation for 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
The canonical SMILES for 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride is CN1C2CCC1CC(N)C2.Cl.Cl.
What is the InChIKey of 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
The InChIKey is KVYQKWPZQKGICY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2.2ClH/c1-10-7-2-3-8(10)5-6(9)4-7;;/h6-8H,2-5,9H2,1H3;2*1H.
What are the key properties of 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride?
8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride has a molecular weight of 213.15 g/mol, XLogP of 1.41, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methyl-8-azabicyclo[3.2.1]octan-3-amine;dihydrochloride is sourced from PubChem (CID 2775928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).