(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine

C9H18N2 — CID 43316838

IUPAC(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
SMILESCN1C2CCC1CC(CN)C2
InChIInChI=1S/C9H18N2/c1-11-8-2-3-9(11)5-7(4-8)6-10/h7-9H,2-6,10H2,1H3
InChIKeyJDLGJYZMVRWAQA-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.82
Rot. Bonds1

About (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine

(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine (PubChem CID 43316838) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine.

Molecular Properties

Compound Name(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
PubChem CID43316838
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine
SMILESCN1C2CCC1CC(CN)C2
InChIInChI=1S/C9H18N2/c1-11-8-2-3-9(11)5-7(4-8)6-10/h7-9H,2-6,10H2,1H3
InChIKeyJDLGJYZMVRWAQA-UHFFFAOYSA-N
XLogP0.82
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.82
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-yl)methanamine?
The IUPAC name of (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine (CID 43316838) is (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine.
What is the SMILES notation for (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine?
The canonical SMILES for (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine is CN1C2CCC1CC(CN)C2.
What is the InChIKey of (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine?
The InChIKey is JDLGJYZMVRWAQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-11-8-2-3-9(11)5-7(4-8)6-10/h7-9H,2-6,10H2,1H3.
What are the key properties of (8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine?
(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methanamine has a molecular weight of 154.26 g/mol, XLogP of 0.82, 1 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-yl)methanamine is sourced from PubChem (CID 43316838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).