2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite

C6H16Cl2N4O — CID 158894978

IUPAC2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite
SMILESCC(C)(N)N=NC(C)(C)N.ClOCl
InChIInChI=1S/C6H16N4.Cl2O/c1-5(2,7)9-10-6(3,4)8;1-3-2/h7-8H2,1-4H3;
InChIKeyJESKQFOQSFGMOS-UHFFFAOYSA-N
MW231.13 g/mol
LogP2.14
Rot. Bonds2

About 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite

2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite (PubChem CID 158894978) has the molecular formula C6H16Cl2N4O and a molecular weight of 231.13 g/mol. Its IUPAC name is 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite.

Molecular Properties

Compound Name2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite
PubChem CID158894978
Molecular FormulaC6H16Cl2N4O
Molecular Weight231.13 g/mol
Exact Mass230.07
IUPAC Name2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite
SMILESCC(C)(N)N=NC(C)(C)N.ClOCl
InChIInChI=1S/C6H16N4.Cl2O/c1-5(2,7)9-10-6(3,4)8;1-3-2/h7-8H2,1-4H3;
InChIKeyJESKQFOQSFGMOS-UHFFFAOYSA-N
XLogP2.14
TPSA85.99 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.13
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}

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Related Compounds

chloro hypochlorite;chloromethane;phosphane
CID 157074558
chloro hypochlorite;2-methyl-2-[(2-methylpropan-2-yl)oxy]propane
CID 160856003
formyl chloride;2-methylpropan-2-amine
CID 175033696
1,1,1-trimethoxy-2-methylpropan-2-amine
CID 178171050
CID 90308761
CID 90308761
hydrazine;2-methoxy-2-methylpropane
CID 158568740
2-iodo-3-methylbutane-2,3-diamine
CID 163792555
CID 175795972
CID 175795972
2,2-dichloropropane;zinc
CID 162195997
tetrakis(2,2-dimethylpropane);bis(2-methylpropan-2-amine)
CID 159299187
bis(2-methylpropan-2-amine);dihydrochloride
CID 175186319
ethane;2-methylpropan-2-amine
CID 142052554

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite?
The IUPAC name of 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite (CID 158894978) is 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite.
What is the SMILES notation for 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite?
The canonical SMILES for 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite is CC(C)(N)N=NC(C)(C)N.ClOCl.
What is the InChIKey of 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite?
The InChIKey is JESKQFOQSFGMOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H16N4.Cl2O/c1-5(2,7)9-10-6(3,4)8;1-3-2/h7-8H2,1-4H3;.
What are the key properties of 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite?
2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite has a molecular weight of 231.13 g/mol, XLogP of 2.14, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminopropan-2-yldiazenyl)propan-2-amine;chloro hypochlorite is sourced from PubChem (CID 158894978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).