azanium;adamantane;hydroxide

C10H21NO — CID 139557020

IUPACazanium;adamantane;hydroxide
SMILESC1C2CC3CC1CC(C2)C3.[NH4+].[OH-]
InChIInChI=1S/C10H16.H3N.H2O/c1-7-2-9-4-8(1)5-10(3-7)6-9;;/h7-10H,1-6H2;1H3;1H2
InChIKeyWXYROFYBQRRCEN-UHFFFAOYSA-N
MW171.28 g/mol
LogP3.03
Rot. Bonds

About azanium;adamantane;hydroxide

azanium;adamantane;hydroxide (PubChem CID 139557020) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is azanium;adamantane;hydroxide.

Molecular Properties

Compound Nameazanium;adamantane;hydroxide
PubChem CID139557020
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Nameazanium;adamantane;hydroxide
SMILESC1C2CC3CC1CC(C2)C3.[NH4+].[OH-]
InChIInChI=1S/C10H16.H3N.H2O/c1-7-2-9-4-8(1)5-10(3-7)6-9;;/h7-10H,1-6H2;1H3;1H2
InChIKeyWXYROFYBQRRCEN-UHFFFAOYSA-N
XLogP3.03
TPSA66.50 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

pentacyclo[9.5.1.13,9.15,15.17,13]icosane
CID 86001136
adamantane;ruthenium(2+)
CID 175795757
adamantane;hydrobromide
CID 68587587
adamantane;hydrate
CID 137498586
adamantane;ethane
CID 90892828
adamantane;azane;trihydrochloride
CID 172754322
adamantane;cycloheptane
CID 173136693
adamantane;hydrogen peroxide
CID 159706724
adamantane;ethane;methane
CID 157076952
adamantane;methanol
CID 21094834
adamantane;N-methylmethanamine
CID 20975909
adamantane;methane;methanol
CID 174446810

Frequently Asked Questions

What is the IUPAC name of azanium;adamantane;hydroxide?
The IUPAC name of azanium;adamantane;hydroxide (CID 139557020) is azanium;adamantane;hydroxide.
What is the SMILES notation for azanium;adamantane;hydroxide?
The canonical SMILES for azanium;adamantane;hydroxide is C1C2CC3CC1CC(C2)C3.[NH4+].[OH-].
What is the InChIKey of azanium;adamantane;hydroxide?
The InChIKey is WXYROFYBQRRCEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16.H3N.H2O/c1-7-2-9-4-8(1)5-10(3-7)6-9;;/h7-10H,1-6H2;1H3;1H2.
What are the key properties of azanium;adamantane;hydroxide?
azanium;adamantane;hydroxide has a molecular weight of 171.28 g/mol, XLogP of 3.03, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;adamantane;hydroxide is sourced from PubChem (CID 139557020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).