N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride

C8H16ClN — CID 3021671

IUPACN-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride
SMILESCNC1CC2CCC1C2.Cl
InChIInChI=1S/C8H15N.ClH/c1-9-8-5-6-2-3-7(8)4-6;/h6-9H,2-5H2,1H3;1H
InChIKeyNGQMCJXJNPZWGI-UHFFFAOYSA-N
MW161.68 g/mol
LogP1.82
Rot. Bonds1

About N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride

N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride (PubChem CID 3021671) has the molecular formula C8H16ClN and a molecular weight of 161.68 g/mol. Its IUPAC name is N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride.

Molecular Properties

Compound NameN-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride
PubChem CID3021671
Molecular FormulaC8H16ClN
Molecular Weight161.68 g/mol
Exact Mass161.10
IUPAC NameN-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride
SMILESCNC1CC2CCC1C2.Cl
InChIInChI=1S/C8H15N.ClH/c1-9-8-5-6-2-3-7(8)4-6;/h6-9H,2-5H2,1H3;1H
InChIKeyNGQMCJXJNPZWGI-UHFFFAOYSA-N
XLogP1.82
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.68
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride?
The IUPAC name of N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride (CID 3021671) is N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride.
What is the SMILES notation for N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride?
The canonical SMILES for N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride is CNC1CC2CCC1C2.Cl.
What is the InChIKey of N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride?
The InChIKey is NGQMCJXJNPZWGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N.ClH/c1-9-8-5-6-2-3-7(8)4-6;/h6-9H,2-5H2,1H3;1H.
What are the key properties of N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride?
N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride has a molecular weight of 161.68 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methylbicyclo[2.2.1]heptan-2-amine;hydrochloride is sourced from PubChem (CID 3021671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).