N-ethyladamantan-1-amine;hydrochloride

C12H22ClN — CID 19479

IUPACN-ethyladamantan-1-amine;hydrochloride
SMILESCCNC12CC3CC(CC(C3)C1)C2.Cl
InChIInChI=1S/C12H21N.ClH/c1-2-13-12-6-9-3-10(7-12)5-11(4-9)8-12;/h9-11,13H,2-8H2,1H3;1H
InChIKeyQBPTZTSMOGAMPF-UHFFFAOYSA-N
MW215.77 g/mol
LogP2.99
Rot. Bonds2

About N-ethyladamantan-1-amine;hydrochloride

N-ethyladamantan-1-amine;hydrochloride (PubChem CID 19479) has the molecular formula C12H22ClN and a molecular weight of 215.77 g/mol. Its IUPAC name is N-ethyladamantan-1-amine;hydrochloride.

Molecular Properties

Compound NameN-ethyladamantan-1-amine;hydrochloride
PubChem CID19479
Molecular FormulaC12H22ClN
Molecular Weight215.77 g/mol
Exact Mass215.14
IUPAC NameN-ethyladamantan-1-amine;hydrochloride
SMILESCCNC12CC3CC(CC(C3)C1)C2.Cl
InChIInChI=1S/C12H21N.ClH/c1-2-13-12-6-9-3-10(7-12)5-11(4-9)8-12;/h9-11,13H,2-8H2,1H3;1H
InChIKeyQBPTZTSMOGAMPF-UHFFFAOYSA-N
XLogP2.99
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.77
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyladamantan-1-amine;hydrochloride?
The IUPAC name of N-ethyladamantan-1-amine;hydrochloride (CID 19479) is N-ethyladamantan-1-amine;hydrochloride.
What is the SMILES notation for N-ethyladamantan-1-amine;hydrochloride?
The canonical SMILES for N-ethyladamantan-1-amine;hydrochloride is CCNC12CC3CC(CC(C3)C1)C2.Cl.
What is the InChIKey of N-ethyladamantan-1-amine;hydrochloride?
The InChIKey is QBPTZTSMOGAMPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N.ClH/c1-2-13-12-6-9-3-10(7-12)5-11(4-9)8-12;/h9-11,13H,2-8H2,1H3;1H.
What are the key properties of N-ethyladamantan-1-amine;hydrochloride?
N-ethyladamantan-1-amine;hydrochloride has a molecular weight of 215.77 g/mol, XLogP of 2.99, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyladamantan-1-amine;hydrochloride is sourced from PubChem (CID 19479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).