1-aminoadamantan-2-one;hydrochloride

C10H16ClNO — CID 12563251

IUPAC1-aminoadamantan-2-one;hydrochloride
SMILESCl.NC12CC3CC(CC(C3)C1=O)C2
InChIInChI=1S/C10H15NO.ClH/c11-10-4-6-1-7(5-10)3-8(2-6)9(10)12;/h6-8H,1-5,11H2;1H
InChIKeyPFRVOVVRDXKFAE-UHFFFAOYSA-N
MW201.70 g/mol
LogP1.51
Rot. Bonds

About 1-aminoadamantan-2-one;hydrochloride

1-aminoadamantan-2-one;hydrochloride (PubChem CID 12563251) has the molecular formula C10H16ClNO and a molecular weight of 201.70 g/mol. Its IUPAC name is 1-aminoadamantan-2-one;hydrochloride.

Molecular Properties

Compound Name1-aminoadamantan-2-one;hydrochloride
PubChem CID12563251
Molecular FormulaC10H16ClNO
Molecular Weight201.70 g/mol
Exact Mass201.09
IUPAC Name1-aminoadamantan-2-one;hydrochloride
SMILESCl.NC12CC3CC(CC(C3)C1=O)C2
InChIInChI=1S/C10H15NO.ClH/c11-10-4-6-1-7(5-10)3-8(2-6)9(10)12;/h6-8H,1-5,11H2;1H
InChIKeyPFRVOVVRDXKFAE-UHFFFAOYSA-N
XLogP1.51
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.70
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-aminoadamantan-2-one;hydrochloride?
The IUPAC name of 1-aminoadamantan-2-one;hydrochloride (CID 12563251) is 1-aminoadamantan-2-one;hydrochloride.
What is the SMILES notation for 1-aminoadamantan-2-one;hydrochloride?
The canonical SMILES for 1-aminoadamantan-2-one;hydrochloride is Cl.NC12CC3CC(CC(C3)C1=O)C2.
What is the InChIKey of 1-aminoadamantan-2-one;hydrochloride?
The InChIKey is PFRVOVVRDXKFAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO.ClH/c11-10-4-6-1-7(5-10)3-8(2-6)9(10)12;/h6-8H,1-5,11H2;1H.
What are the key properties of 1-aminoadamantan-2-one;hydrochloride?
1-aminoadamantan-2-one;hydrochloride has a molecular weight of 201.70 g/mol, XLogP of 1.51, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminoadamantan-2-one;hydrochloride is sourced from PubChem (CID 12563251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).