2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine

C10H11F4N — CID 84735274

IUPAC2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine
SMILESCNCC(F)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C10H11F4N/c1-15-7-9(11,10(12,13)14)8-5-3-2-4-6-8/h2-6,15H,7H2,1H3
InChIKeyHFNGLGOUEHDWMQ-UHFFFAOYSA-N
MW221.20 g/mol
LogP2.63
Rot. Bonds3

About 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine

2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine (PubChem CID 84735274) has the molecular formula C10H11F4N and a molecular weight of 221.20 g/mol. Its IUPAC name is 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine.

Molecular Properties

Compound Name2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine
PubChem CID84735274
Molecular FormulaC10H11F4N
Molecular Weight221.20 g/mol
Exact Mass221.08
IUPAC Name2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine
SMILESCNCC(F)(c1ccccc1)C(F)(F)F
InChIInChI=1S/C10H11F4N/c1-15-7-9(11,10(12,13)14)8-5-3-2-4-6-8/h2-6,15H,7H2,1H3
InChIKeyHFNGLGOUEHDWMQ-UHFFFAOYSA-N
XLogP2.63
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.20
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,3,3,3-tetrafluoro-2-(4-fluorophenyl)-N-methylpropan-1-amine
CID 84736788
[(2R)-1,1,1,2,3-pentafluoropropan-2-yl]benzene
CID 124636792
1-(methylamino)-2-phenylpropan-2-ol;palladium;tetrahydrochloride
CID 173355754
2-ethyl-N-methyl-2-phenylbutan-1-amine
CID 62596018
3,4,4,4-tetrafluoro-3-phenylbutanoic acid
CID 84736567
3-fluoro-N-methyl-3-phenylbutan-1-amine
CID 105439612
N-(2-fluorophenyl)-N,N',2-trimethyl-2-phenylpropane-1,3-diamine
CID 62260635
2-(methylaminomethyl)-2-phenylbutan-1-ol
CID 13463568
1-(methylamino)-2-[2-(trifluoromethyl)phenyl]propan-2-ol
CID 62773966
2-[(2,2-difluoro-2-phenylethyl)amino]-2-methylpropan-1-ol
CID 116788835
1,1,1-trifluoro-3-methoxy-N-methyl-2-phenylpropan-2-amine
CID 103466015
N-(2,2-difluoro-2-phenylethyl)-2,4,4-trimethylpentan-2-amine
CID 116788975

Frequently Asked Questions

What is the IUPAC name of 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine?
The IUPAC name of 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine (CID 84735274) is 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine.
What is the SMILES notation for 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine?
The canonical SMILES for 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine is CNCC(F)(c1ccccc1)C(F)(F)F.
What is the InChIKey of 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine?
The InChIKey is HFNGLGOUEHDWMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11F4N/c1-15-7-9(11,10(12,13)14)8-5-3-2-4-6-8/h2-6,15H,7H2,1H3.
What are the key properties of 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine?
2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine has a molecular weight of 221.20 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,3,3-tetrafluoro-N-methyl-2-phenylpropan-1-amine is sourced from PubChem (CID 84735274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).