(2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine

C8H16N2 — CID 130003083

IUPAC(2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine
SMILESCN1CC2CCC1C2CN
InChIInChI=1S/C8H16N2/c1-10-5-6-2-3-8(10)7(6)4-9/h6-8H,2-5,9H2,1H3
InChIKeyQHNMLBSVABJTGT-UHFFFAOYSA-N
MW140.23 g/mol
LogP0.29
Rot. Bonds1

About (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine

(2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine (PubChem CID 130003083) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine.

Molecular Properties

Compound Name(2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine
PubChem CID130003083
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name(2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine
SMILESCN1CC2CCC1C2CN
InChIInChI=1S/C8H16N2/c1-10-5-6-2-3-8(10)7(6)4-9/h6-8H,2-5,9H2,1H3
InChIKeyQHNMLBSVABJTGT-UHFFFAOYSA-N
XLogP0.29
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
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 (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine?
The IUPAC name of (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine (CID 130003083) is (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine.
What is the SMILES notation for (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine?
The canonical SMILES for (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine is CN1CC2CCC1C2CN.
What is the InChIKey of (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine?
The InChIKey is QHNMLBSVABJTGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2/c1-10-5-6-2-3-8(10)7(6)4-9/h6-8H,2-5,9H2,1H3.
What are the key properties of (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine?
(2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine has a molecular weight of 140.23 g/mol, XLogP of 0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-methyl-2-azabicyclo[2.2.1]heptan-7-yl)methanamine is sourced from PubChem (CID 130003083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).