azane;2-methylpropan-2-ol;hydrobromide

C4H14BrNO — CID 173305013

IUPACazane;2-methylpropan-2-ol;hydrobromide
SMILESBr.CC(C)(C)O.N
InChIInChI=1S/C4H10O.BrH.H3N/c1-4(2,3)5;;/h5H,1-3H3;1H;1H3
InChIKeyIJYBPBUESNDDDV-UHFFFAOYSA-N
MW172.07 g/mol
LogP1.52
Rot. Bonds

About azane;2-methylpropan-2-ol;hydrobromide

azane;2-methylpropan-2-ol;hydrobromide (PubChem CID 173305013) has the molecular formula C4H14BrNO and a molecular weight of 172.07 g/mol. Its IUPAC name is azane;2-methylpropan-2-ol;hydrobromide.

Molecular Properties

Compound Nameazane;2-methylpropan-2-ol;hydrobromide
PubChem CID173305013
Molecular FormulaC4H14BrNO
Molecular Weight172.07 g/mol
Exact Mass171.03
IUPAC Nameazane;2-methylpropan-2-ol;hydrobromide
SMILESBr.CC(C)(C)O.N
InChIInChI=1S/C4H10O.BrH.H3N/c1-4(2,3)5;;/h5H,1-3H3;1H;1H3
InChIKeyIJYBPBUESNDDDV-UHFFFAOYSA-N
XLogP1.52
TPSA55.23 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.07
LogP ≤ 51.52
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azane;2-methylpropan-2-ol;hydrobromide?
The IUPAC name of azane;2-methylpropan-2-ol;hydrobromide (CID 173305013) is azane;2-methylpropan-2-ol;hydrobromide.
What is the SMILES notation for azane;2-methylpropan-2-ol;hydrobromide?
The canonical SMILES for azane;2-methylpropan-2-ol;hydrobromide is Br.CC(C)(C)O.N.
What is the InChIKey of azane;2-methylpropan-2-ol;hydrobromide?
The InChIKey is IJYBPBUESNDDDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O.BrH.H3N/c1-4(2,3)5;;/h5H,1-3H3;1H;1H3.
What are the key properties of azane;2-methylpropan-2-ol;hydrobromide?
azane;2-methylpropan-2-ol;hydrobromide has a molecular weight of 172.07 g/mol, XLogP of 1.52, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azane;2-methylpropan-2-ol;hydrobromide is sourced from PubChem (CID 173305013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).