tert-butyl(dimethyl)azanium

C6H16N+ — CID 6993921

IUPACtert-butyl(dimethyl)azanium
SMILESC[NH+](C)C(C)(C)C
InChIInChI=1S/C6H15N/c1-6(2,3)7(4)5/h1-5H3/p+1
InChIKeyOXQMIXBVXHWDPX-UHFFFAOYSA-O
MW102.20 g/mol
LogP-0.07
Rot. Bonds

About tert-butyl(dimethyl)azanium

tert-butyl(dimethyl)azanium (PubChem CID 6993921) has the molecular formula C6H16N+ and a molecular weight of 102.20 g/mol. Its IUPAC name is tert-butyl(dimethyl)azanium.

Molecular Properties

Compound Nametert-butyl(dimethyl)azanium
PubChem CID6993921
Molecular FormulaC6H16N+
Molecular Weight102.20 g/mol
Exact Mass102.13
IUPAC Nametert-butyl(dimethyl)azanium
SMILESC[NH+](C)C(C)(C)C
InChIInChI=1S/C6H15N/c1-6(2,3)7(4)5/h1-5H3/p+1
InChIKeyOXQMIXBVXHWDPX-UHFFFAOYSA-O
XLogP-0.07
TPSA4.44 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.20
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of tert-butyl(dimethyl)azanium?
The IUPAC name of tert-butyl(dimethyl)azanium (CID 6993921) is tert-butyl(dimethyl)azanium.
What is the SMILES notation for tert-butyl(dimethyl)azanium?
The canonical SMILES for tert-butyl(dimethyl)azanium is C[NH+](C)C(C)(C)C.
What is the InChIKey of tert-butyl(dimethyl)azanium?
The InChIKey is OXQMIXBVXHWDPX-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H15N/c1-6(2,3)7(4)5/h1-5H3/p+1.
What are the key properties of tert-butyl(dimethyl)azanium?
tert-butyl(dimethyl)azanium has a molecular weight of 102.20 g/mol, XLogP of -0.07, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl(dimethyl)azanium is sourced from PubChem (CID 6993921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).