2,3-dimethylbutan-2-ylazanium

C6H16N+ — CID 19594176

IUPAC2,3-dimethylbutan-2-ylazanium
SMILESCC(C)C(C)(C)[NH3+]
InChIInChI=1S/C6H15N/c1-5(2)6(3,4)7/h5H,7H2,1-4H3/p+1
InChIKeyYQNVPNRHJFZONU-UHFFFAOYSA-O
MW102.20 g/mol
LogP0.66
Rot. Bonds1

About 2,3-dimethylbutan-2-ylazanium

2,3-dimethylbutan-2-ylazanium (PubChem CID 19594176) has the molecular formula C6H16N+ and a molecular weight of 102.20 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-ylazanium.

Molecular Properties

Compound Name2,3-dimethylbutan-2-ylazanium
PubChem CID19594176
Molecular FormulaC6H16N+
Molecular Weight102.20 g/mol
Exact Mass102.13
IUPAC Name2,3-dimethylbutan-2-ylazanium
SMILESCC(C)C(C)(C)[NH3+]
InChIInChI=1S/C6H15N/c1-5(2)6(3,4)7/h5H,7H2,1-4H3/p+1
InChIKeyYQNVPNRHJFZONU-UHFFFAOYSA-O
XLogP0.66
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500102.20
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

2,2-dibromo-3-methylbutane
CID 13047634
2,3-dimethyl(213C)butan-2-ol
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CID 123563572
N-(2,3,4-trimethylpentan-3-yl)methanimine
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2,3-dimethylbutan-2-ol;titanium
CID 151633599
azane;2-bromo-2,3-dimethylbutane
CID 131989139
2,5-dimethyl-3,3,4,4-tetra(propan-2-yl)hexane
CID 86018360
2,3,3,4,4,5,5,6,6,7,7,8-dodecamethylnonane
CID 58764501
2-chloro-2-fluoro-3-methylbutane
CID 88897527
2,3,4-trimethylpentan-3-amine;hydrobromide
CID 18185119
(2S)-2-hydroxy-3-methylbutan-2-olate
CID 59952741
CID 87631272
CID 87631272

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-ylazanium?
The IUPAC name of 2,3-dimethylbutan-2-ylazanium (CID 19594176) is 2,3-dimethylbutan-2-ylazanium.
What is the SMILES notation for 2,3-dimethylbutan-2-ylazanium?
The canonical SMILES for 2,3-dimethylbutan-2-ylazanium is CC(C)C(C)(C)[NH3+].
What is the InChIKey of 2,3-dimethylbutan-2-ylazanium?
The InChIKey is YQNVPNRHJFZONU-UHFFFAOYSA-O. The full InChI is InChI=1S/C6H15N/c1-5(2)6(3,4)7/h5H,7H2,1-4H3/p+1.
What are the key properties of 2,3-dimethylbutan-2-ylazanium?
2,3-dimethylbutan-2-ylazanium has a molecular weight of 102.20 g/mol, XLogP of 0.66, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-ylazanium is sourced from PubChem (CID 19594176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).