dimethyl-di(propan-2-yl)azanium

C8H20N+ — CID 19885843

IUPACdimethyl-di(propan-2-yl)azanium
SMILESCC(C)[N+](C)(C)C(C)C
InChIInChI=1S/C8H20N/c1-7(2)9(5,6)8(3)4/h7-8H,1-6H3/q+1
InChIKeyGJZAMOYERKVOGF-UHFFFAOYSA-N
MW130.25 g/mol
LogP1.88
Rot. Bonds2

About dimethyl-di(propan-2-yl)azanium

dimethyl-di(propan-2-yl)azanium (PubChem CID 19885843) has the molecular formula C8H20N+ and a molecular weight of 130.25 g/mol. Its IUPAC name is dimethyl-di(propan-2-yl)azanium.

Molecular Properties

Compound Namedimethyl-di(propan-2-yl)azanium
PubChem CID19885843
Molecular FormulaC8H20N+
Molecular Weight130.25 g/mol
Exact Mass130.16
IUPAC Namedimethyl-di(propan-2-yl)azanium
SMILESCC(C)[N+](C)(C)C(C)C
InChIInChI=1S/C8H20N/c1-7(2)9(5,6)8(3)4/h7-8H,1-6H3/q+1
InChIKeyGJZAMOYERKVOGF-UHFFFAOYSA-N
XLogP1.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.25
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of dimethyl-di(propan-2-yl)azanium?
The IUPAC name of dimethyl-di(propan-2-yl)azanium (CID 19885843) is dimethyl-di(propan-2-yl)azanium.
What is the SMILES notation for dimethyl-di(propan-2-yl)azanium?
The canonical SMILES for dimethyl-di(propan-2-yl)azanium is CC(C)[N+](C)(C)C(C)C.
What is the InChIKey of dimethyl-di(propan-2-yl)azanium?
The InChIKey is GJZAMOYERKVOGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N/c1-7(2)9(5,6)8(3)4/h7-8H,1-6H3/q+1.
What are the key properties of dimethyl-di(propan-2-yl)azanium?
dimethyl-di(propan-2-yl)azanium has a molecular weight of 130.25 g/mol, XLogP of 1.88, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-di(propan-2-yl)azanium is sourced from PubChem (CID 19885843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).