2-fluoro-N-propan-2-ylpropan-1-amine

C6H14FN — CID 84647765

IUPAC2-fluoro-N-propan-2-ylpropan-1-amine
SMILESCC(F)CNC(C)C
InChIInChI=1S/C6H14FN/c1-5(2)8-4-6(3)7/h5-6,8H,4H2,1-3H3
InChIKeyQXGSDFDEVLWVKQ-UHFFFAOYSA-N
MW119.18 g/mol
LogP1.34
Rot. Bonds3

About 2-fluoro-N-propan-2-ylpropan-1-amine

2-fluoro-N-propan-2-ylpropan-1-amine (PubChem CID 84647765) has the molecular formula C6H14FN and a molecular weight of 119.18 g/mol. Its IUPAC name is 2-fluoro-N-propan-2-ylpropan-1-amine.

Molecular Properties

Compound Name2-fluoro-N-propan-2-ylpropan-1-amine
PubChem CID84647765
Molecular FormulaC6H14FN
Molecular Weight119.18 g/mol
Exact Mass119.11
IUPAC Name2-fluoro-N-propan-2-ylpropan-1-amine
SMILESCC(F)CNC(C)C
InChIInChI=1S/C6H14FN/c1-5(2)8-4-6(3)7/h5-6,8H,4H2,1-3H3
InChIKeyQXGSDFDEVLWVKQ-UHFFFAOYSA-N
XLogP1.34
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.18
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-propan-2-ylpropan-1-amine?
The IUPAC name of 2-fluoro-N-propan-2-ylpropan-1-amine (CID 84647765) is 2-fluoro-N-propan-2-ylpropan-1-amine.
What is the SMILES notation for 2-fluoro-N-propan-2-ylpropan-1-amine?
The canonical SMILES for 2-fluoro-N-propan-2-ylpropan-1-amine is CC(F)CNC(C)C.
What is the InChIKey of 2-fluoro-N-propan-2-ylpropan-1-amine?
The InChIKey is QXGSDFDEVLWVKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14FN/c1-5(2)8-4-6(3)7/h5-6,8H,4H2,1-3H3.
What are the key properties of 2-fluoro-N-propan-2-ylpropan-1-amine?
2-fluoro-N-propan-2-ylpropan-1-amine has a molecular weight of 119.18 g/mol, XLogP of 1.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-propan-2-ylpropan-1-amine is sourced from PubChem (CID 84647765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).