azane;cyclohexane;hydrochloride

C6H25ClN4 — CID 22163129

IUPACazane;cyclohexane;hydrochloride
SMILESC1CCCCC1.Cl.N.N.N.N
InChIInChI=1S/C6H12.ClH.4H3N/c1-2-4-6-5-3-1;;;;;/h1-6H2;1H;4*1H3
InChIKeyHPSFQQDTXLKTIU-UHFFFAOYSA-N
MW188.75 g/mol
LogP3.41
Rot. Bonds

About azane;cyclohexane;hydrochloride

azane;cyclohexane;hydrochloride (PubChem CID 22163129) has the molecular formula C6H25ClN4 and a molecular weight of 188.75 g/mol. Its IUPAC name is azane;cyclohexane;hydrochloride.

Molecular Properties

Compound Nameazane;cyclohexane;hydrochloride
PubChem CID22163129
Molecular FormulaC6H25ClN4
Molecular Weight188.75 g/mol
Exact Mass188.18
IUPAC Nameazane;cyclohexane;hydrochloride
SMILESC1CCCCC1.Cl.N.N.N.N
InChIInChI=1S/C6H12.ClH.4H3N/c1-2-4-6-5-3-1;;;;;/h1-6H2;1H;4*1H3
InChIKeyHPSFQQDTXLKTIU-UHFFFAOYSA-N
XLogP3.41
TPSA140.00 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.75
LogP ≤ 53.41
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of azane;cyclohexane;hydrochloride?
The IUPAC name of azane;cyclohexane;hydrochloride (CID 22163129) is azane;cyclohexane;hydrochloride.
What is the SMILES notation for azane;cyclohexane;hydrochloride?
The canonical SMILES for azane;cyclohexane;hydrochloride is C1CCCCC1.Cl.N.N.N.N.
What is the InChIKey of azane;cyclohexane;hydrochloride?
The InChIKey is HPSFQQDTXLKTIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12.ClH.4H3N/c1-2-4-6-5-3-1;;;;;/h1-6H2;1H;4*1H3.
What are the key properties of azane;cyclohexane;hydrochloride?
azane;cyclohexane;hydrochloride has a molecular weight of 188.75 g/mol, XLogP of 3.41, 0 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for azane;cyclohexane;hydrochloride is sourced from PubChem (CID 22163129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).