adamantane;azane;trihydrochloride

C10H22Cl3N — CID 172754322

IUPACadamantane;azane;trihydrochloride
SMILESC1C2CC3CC1CC(C2)C3.Cl.Cl.Cl.N
InChIInChI=1S/C10H16.3ClH.H3N/c1-7-2-9-4-8(1)5-10(3-7)6-9;;;;/h7-10H,1-6H2;3*1H;1H3
InChIKeyKUQGSYKXVGRNDA-UHFFFAOYSA-N
MW262.65 g/mol
LogP4.26
Rot. Bonds

About adamantane;azane;trihydrochloride

adamantane;azane;trihydrochloride (PubChem CID 172754322) has the molecular formula C10H22Cl3N and a molecular weight of 262.65 g/mol. Its IUPAC name is adamantane;azane;trihydrochloride.

Molecular Properties

Compound Nameadamantane;azane;trihydrochloride
PubChem CID172754322
Molecular FormulaC10H22Cl3N
Molecular Weight262.65 g/mol
Exact Mass261.08
IUPAC Nameadamantane;azane;trihydrochloride
SMILESC1C2CC3CC1CC(C2)C3.Cl.Cl.Cl.N
InChIInChI=1S/C10H16.3ClH.H3N/c1-7-2-9-4-8(1)5-10(3-7)6-9;;;;/h7-10H,1-6H2;3*1H;1H3
InChIKeyKUQGSYKXVGRNDA-UHFFFAOYSA-N
XLogP4.26
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.65
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of adamantane;azane;trihydrochloride?
The IUPAC name of adamantane;azane;trihydrochloride (CID 172754322) is adamantane;azane;trihydrochloride.
What is the SMILES notation for adamantane;azane;trihydrochloride?
The canonical SMILES for adamantane;azane;trihydrochloride is C1C2CC3CC1CC(C2)C3.Cl.Cl.Cl.N.
What is the InChIKey of adamantane;azane;trihydrochloride?
The InChIKey is KUQGSYKXVGRNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16.3ClH.H3N/c1-7-2-9-4-8(1)5-10(3-7)6-9;;;;/h7-10H,1-6H2;3*1H;1H3.
What are the key properties of adamantane;azane;trihydrochloride?
adamantane;azane;trihydrochloride has a molecular weight of 262.65 g/mol, XLogP of 4.26, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for adamantane;azane;trihydrochloride is sourced from PubChem (CID 172754322), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).