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

C8H16N2 — CID 18541072

IUPAC3-methyl-3-azabicyclo[3.2.1]octan-8-amine
SMILESCN1CC2CCC(C1)C2N
InChIInChI=1S/C8H16N2/c1-10-4-6-2-3-7(5-10)8(6)9/h6-8H,2-5,9H2,1H3
InChIKeyOMNZTTYSHLWCDQ-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.29
Rot. Bonds

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

3-methyl-3-azabicyclo[3.2.1]octan-8-amine (PubChem CID 18541072) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 3-methyl-3-azabicyclo[3.2.1]octan-8-amine.

Molecular Properties

Compound Name3-methyl-3-azabicyclo[3.2.1]octan-8-amine
PubChem CID18541072
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name3-methyl-3-azabicyclo[3.2.1]octan-8-amine
SMILESCN1CC2CCC(C1)C2N
InChIInChI=1S/C8H16N2/c1-10-4-6-2-3-7(5-10)8(6)9/h6-8H,2-5,9H2,1H3
InChIKeyOMNZTTYSHLWCDQ-UHFFFAOYSA-N
XLogP0.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-3-azabicyclo[3.2.1]octan-8-amine?
The IUPAC name of 3-methyl-3-azabicyclo[3.2.1]octan-8-amine (CID 18541072) is 3-methyl-3-azabicyclo[3.2.1]octan-8-amine.
What is the SMILES notation for 3-methyl-3-azabicyclo[3.2.1]octan-8-amine?
The canonical SMILES for 3-methyl-3-azabicyclo[3.2.1]octan-8-amine is CN1CC2CCC(C1)C2N.
What is the InChIKey of 3-methyl-3-azabicyclo[3.2.1]octan-8-amine?
The InChIKey is OMNZTTYSHLWCDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-10-4-6-2-3-7(5-10)8(6)9/h6-8H,2-5,9H2,1H3.
What are the key properties of 3-methyl-3-azabicyclo[3.2.1]octan-8-amine?
3-methyl-3-azabicyclo[3.2.1]octan-8-amine has a molecular weight of 140.23 g/mol, XLogP of 0.29, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-3-azabicyclo[3.2.1]octan-8-amine is sourced from PubChem (CID 18541072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).