2-ethyladamantan-2-amine;hydrochloride

C12H22ClN — CID 44562805

IUPAC2-ethyladamantan-2-amine;hydrochloride
SMILESCCC1(N)C2CC3CC(C2)CC1C3.Cl
InChIInChI=1S/C12H21N.ClH/c1-2-12(13)10-4-8-3-9(6-10)7-11(12)5-8;/h8-11H,2-7,13H2,1H3;1H
InChIKeyJKDUTNHREIIDCM-UHFFFAOYSA-N
MW215.77 g/mol
LogP2.97
Rot. Bonds1

About 2-ethyladamantan-2-amine;hydrochloride

2-ethyladamantan-2-amine;hydrochloride (PubChem CID 44562805) has the molecular formula C12H22ClN and a molecular weight of 215.77 g/mol. Its IUPAC name is 2-ethyladamantan-2-amine;hydrochloride.

Molecular Properties

Compound Name2-ethyladamantan-2-amine;hydrochloride
PubChem CID44562805
Molecular FormulaC12H22ClN
Molecular Weight215.77 g/mol
Exact Mass215.14
IUPAC Name2-ethyladamantan-2-amine;hydrochloride
SMILESCCC1(N)C2CC3CC(C2)CC1C3.Cl
InChIInChI=1S/C12H21N.ClH/c1-2-12(13)10-4-8-3-9(6-10)7-11(12)5-8;/h8-11H,2-7,13H2,1H3;1H
InChIKeyJKDUTNHREIIDCM-UHFFFAOYSA-N
XLogP2.97
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.77
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-ethyladamantan-2-amine;hydrochloride?
The IUPAC name of 2-ethyladamantan-2-amine;hydrochloride (CID 44562805) is 2-ethyladamantan-2-amine;hydrochloride.
What is the SMILES notation for 2-ethyladamantan-2-amine;hydrochloride?
The canonical SMILES for 2-ethyladamantan-2-amine;hydrochloride is CCC1(N)C2CC3CC(C2)CC1C3.Cl.
What is the InChIKey of 2-ethyladamantan-2-amine;hydrochloride?
The InChIKey is JKDUTNHREIIDCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N.ClH/c1-2-12(13)10-4-8-3-9(6-10)7-11(12)5-8;/h8-11H,2-7,13H2,1H3;1H.
What are the key properties of 2-ethyladamantan-2-amine;hydrochloride?
2-ethyladamantan-2-amine;hydrochloride has a molecular weight of 215.77 g/mol, XLogP of 2.97, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyladamantan-2-amine;hydrochloride is sourced from PubChem (CID 44562805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).