2-methylpropan-1-amine;hydrofluoride

C4H12FN — CID 19956607

IUPAC2-methylpropan-1-amine;hydrofluoride
SMILESCC(C)CN.F
InChIInChI=1S/C4H11N.FH/c1-4(2)3-5;/h4H,3,5H2,1-2H3;1H
InChIKeyKWSZHTUKVKNGDF-UHFFFAOYSA-N
MW93.14 g/mol
LogP0.75
Rot. Bonds1

About 2-methylpropan-1-amine;hydrofluoride

2-methylpropan-1-amine;hydrofluoride (PubChem CID 19956607) has the molecular formula C4H12FN and a molecular weight of 93.14 g/mol. Its IUPAC name is 2-methylpropan-1-amine;hydrofluoride.

Molecular Properties

Compound Name2-methylpropan-1-amine;hydrofluoride
PubChem CID19956607
Molecular FormulaC4H12FN
Molecular Weight93.14 g/mol
Exact Mass93.10
IUPAC Name2-methylpropan-1-amine;hydrofluoride
SMILESCC(C)CN.F
InChIInChI=1S/C4H11N.FH/c1-4(2)3-5;/h4H,3,5H2,1-2H3;1H
InChIKeyKWSZHTUKVKNGDF-UHFFFAOYSA-N
XLogP0.75
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50093.14
LogP ≤ 50.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropan-1-amine;hydrofluoride?
The IUPAC name of 2-methylpropan-1-amine;hydrofluoride (CID 19956607) is 2-methylpropan-1-amine;hydrofluoride.
What is the SMILES notation for 2-methylpropan-1-amine;hydrofluoride?
The canonical SMILES for 2-methylpropan-1-amine;hydrofluoride is CC(C)CN.F.
What is the InChIKey of 2-methylpropan-1-amine;hydrofluoride?
The InChIKey is KWSZHTUKVKNGDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11N.FH/c1-4(2)3-5;/h4H,3,5H2,1-2H3;1H.
What are the key properties of 2-methylpropan-1-amine;hydrofluoride?
2-methylpropan-1-amine;hydrofluoride has a molecular weight of 93.14 g/mol, XLogP of 0.75, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropan-1-amine;hydrofluoride is sourced from PubChem (CID 19956607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).