1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride

C10H20ClN — CID 16896384

IUPAC1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride
SMILESCNC(C)C1CC2CCC1C2.Cl
InChIInChI=1S/C10H19N.ClH/c1-7(11-2)10-6-8-3-4-9(10)5-8;/h7-11H,3-6H2,1-2H3;1H
InChIKeyOGFASMAUWMRMIN-UHFFFAOYSA-N
MW189.73 g/mol
LogP2.45
Rot. Bonds2

About 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride

1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride (PubChem CID 16896384) has the molecular formula C10H20ClN and a molecular weight of 189.73 g/mol. Its IUPAC name is 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride.

Molecular Properties

Compound Name1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride
PubChem CID16896384
Molecular FormulaC10H20ClN
Molecular Weight189.73 g/mol
Exact Mass189.13
IUPAC Name1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride
SMILESCNC(C)C1CC2CCC1C2.Cl
InChIInChI=1S/C10H19N.ClH/c1-7(11-2)10-6-8-3-4-9(10)5-8;/h7-11H,3-6H2,1-2H3;1H
InChIKeyOGFASMAUWMRMIN-UHFFFAOYSA-N
XLogP2.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.73
LogP ≤ 52.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride?
The IUPAC name of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride (CID 16896384) is 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride.
What is the SMILES notation for 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride?
The canonical SMILES for 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride is CNC(C)C1CC2CCC1C2.Cl.
What is the InChIKey of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride?
The InChIKey is OGFASMAUWMRMIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N.ClH/c1-7(11-2)10-6-8-3-4-9(10)5-8;/h7-11H,3-6H2,1-2H3;1H.
What are the key properties of 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride?
1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride has a molecular weight of 189.73 g/mol, XLogP of 2.45, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-bicyclo[2.2.1]heptanyl)-N-methylethanamine;hydrochloride is sourced from PubChem (CID 16896384), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).