N-ethyl-2-fluoro-N-methylpropan-2-amine

C6H14FN — CID 123966914

IUPACN-ethyl-2-fluoro-N-methylpropan-2-amine
SMILESCCN(C)C(C)(C)F
InChIInChI=1S/C6H14FN/c1-5-8(4)6(2,3)7/h5H2,1-4H3
InChIKeyQPFCKJOJGGJAEO-UHFFFAOYSA-N
MW119.18 g/mol
LogP1.64
Rot. Bonds2

About N-ethyl-2-fluoro-N-methylpropan-2-amine

N-ethyl-2-fluoro-N-methylpropan-2-amine (PubChem CID 123966914) has the molecular formula C6H14FN and a molecular weight of 119.18 g/mol. Its IUPAC name is N-ethyl-2-fluoro-N-methylpropan-2-amine.

Molecular Properties

Compound NameN-ethyl-2-fluoro-N-methylpropan-2-amine
PubChem CID123966914
Molecular FormulaC6H14FN
Molecular Weight119.18 g/mol
Exact Mass119.11
IUPAC NameN-ethyl-2-fluoro-N-methylpropan-2-amine
SMILESCCN(C)C(C)(C)F
InChIInChI=1S/C6H14FN/c1-5-8(4)6(2,3)7/h5H2,1-4H3
InChIKeyQPFCKJOJGGJAEO-UHFFFAOYSA-N
XLogP1.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500119.18
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-fluoro-N-methylpropan-2-amine?
The IUPAC name of N-ethyl-2-fluoro-N-methylpropan-2-amine (CID 123966914) is N-ethyl-2-fluoro-N-methylpropan-2-amine.
What is the SMILES notation for N-ethyl-2-fluoro-N-methylpropan-2-amine?
The canonical SMILES for N-ethyl-2-fluoro-N-methylpropan-2-amine is CCN(C)C(C)(C)F.
What is the InChIKey of N-ethyl-2-fluoro-N-methylpropan-2-amine?
The InChIKey is QPFCKJOJGGJAEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14FN/c1-5-8(4)6(2,3)7/h5H2,1-4H3.
What are the key properties of N-ethyl-2-fluoro-N-methylpropan-2-amine?
N-ethyl-2-fluoro-N-methylpropan-2-amine has a molecular weight of 119.18 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-fluoro-N-methylpropan-2-amine is sourced from PubChem (CID 123966914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).