adamantan-2-amine;hydrochloride

C10H18ClN — CID 25331

IUPACadamantan-2-amine;hydrochloride
SMILESCl.NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C10H17N.ClH/c11-10-8-2-6-1-7(4-8)5-9(10)3-6;/h6-10H,1-5,11H2;1H
InChIKeyWLDWDRZITJEWRJ-UHFFFAOYSA-N
MW187.71 g/mol
LogP2.19
Rot. Bonds

About adamantan-2-amine;hydrochloride

adamantan-2-amine;hydrochloride (PubChem CID 25331) has the molecular formula C10H18ClN and a molecular weight of 187.71 g/mol. Its IUPAC name is adamantan-2-amine;hydrochloride.

Molecular Properties

Compound Nameadamantan-2-amine;hydrochloride
PubChem CID25331
Molecular FormulaC10H18ClN
Molecular Weight187.71 g/mol
Exact Mass187.11
IUPAC Nameadamantan-2-amine;hydrochloride
SMILESCl.NC1C2CC3CC(C2)CC1C3
InChIInChI=1S/C10H17N.ClH/c11-10-8-2-6-1-7(4-8)5-9(10)3-6;/h6-10H,1-5,11H2;1H
InChIKeyWLDWDRZITJEWRJ-UHFFFAOYSA-N
XLogP2.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.71
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of adamantan-2-amine;hydrochloride?
The IUPAC name of adamantan-2-amine;hydrochloride (CID 25331) is adamantan-2-amine;hydrochloride.
What is the SMILES notation for adamantan-2-amine;hydrochloride?
The canonical SMILES for adamantan-2-amine;hydrochloride is Cl.NC1C2CC3CC(C2)CC1C3.
What is the InChIKey of adamantan-2-amine;hydrochloride?
The InChIKey is WLDWDRZITJEWRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N.ClH/c11-10-8-2-6-1-7(4-8)5-9(10)3-6;/h6-10H,1-5,11H2;1H.
What are the key properties of adamantan-2-amine;hydrochloride?
adamantan-2-amine;hydrochloride has a molecular weight of 187.71 g/mol, XLogP of 2.19, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for adamantan-2-amine;hydrochloride is sourced from PubChem (CID 25331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).