1-aminoadamantan-2-ol

C10H17NO — CID 12563267

IUPAC1-aminoadamantan-2-ol
SMILESNC12CC3CC(CC(C3)C1O)C2
InChIInChI=1S/C10H17NO/c11-10-4-6-1-7(5-10)3-8(2-6)9(10)12/h6-9,12H,1-5,11H2
InChIKeyKAUMSDCJVYEECC-UHFFFAOYSA-N
MW167.25 g/mol
LogP0.88
Rot. Bonds

About 1-aminoadamantan-2-ol

1-aminoadamantan-2-ol (PubChem CID 12563267) has the molecular formula C10H17NO and a molecular weight of 167.25 g/mol. Its IUPAC name is 1-aminoadamantan-2-ol.

Molecular Properties

Compound Name1-aminoadamantan-2-ol
PubChem CID12563267
Molecular FormulaC10H17NO
Molecular Weight167.25 g/mol
Exact Mass167.13
IUPAC Name1-aminoadamantan-2-ol
SMILESNC12CC3CC(CC(C3)C1O)C2
InChIInChI=1S/C10H17NO/c11-10-4-6-1-7(5-10)3-8(2-6)9(10)12/h6-9,12H,1-5,11H2
InChIKeyKAUMSDCJVYEECC-UHFFFAOYSA-N
XLogP0.88
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.25
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-aminoadamantan-2-ol?
The IUPAC name of 1-aminoadamantan-2-ol (CID 12563267) is 1-aminoadamantan-2-ol.
What is the SMILES notation for 1-aminoadamantan-2-ol?
The canonical SMILES for 1-aminoadamantan-2-ol is NC12CC3CC(CC(C3)C1O)C2.
What is the InChIKey of 1-aminoadamantan-2-ol?
The InChIKey is KAUMSDCJVYEECC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NO/c11-10-4-6-1-7(5-10)3-8(2-6)9(10)12/h6-9,12H,1-5,11H2.
What are the key properties of 1-aminoadamantan-2-ol?
1-aminoadamantan-2-ol has a molecular weight of 167.25 g/mol, XLogP of 0.88, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-aminoadamantan-2-ol is sourced from PubChem (CID 12563267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).