1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine

C10H13F2N — CID 83853539

IUPAC1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine
SMILESCC(C)(N)C(F)c1ccccc1F
InChIInChI=1S/C10H13F2N/c1-10(2,13)9(12)7-5-3-4-6-8(7)11/h3-6,9H,13H2,1-2H3
InChIKeyAHASLMYDUXYDGZ-UHFFFAOYSA-N
MW185.22 g/mol
LogP2.57
Rot. Bonds2

About 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine

1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine (PubChem CID 83853539) has the molecular formula C10H13F2N and a molecular weight of 185.22 g/mol. Its IUPAC name is 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine.

Molecular Properties

Compound Name1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine
PubChem CID83853539
Molecular FormulaC10H13F2N
Molecular Weight185.22 g/mol
Exact Mass185.10
IUPAC Name1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine
SMILESCC(C)(N)C(F)c1ccccc1F
InChIInChI=1S/C10H13F2N/c1-10(2,13)9(12)7-5-3-4-6-8(7)11/h3-6,9H,13H2,1-2H3
InChIKeyAHASLMYDUXYDGZ-UHFFFAOYSA-N
XLogP2.57
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.22
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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(1S)-1-(2-fluorophenyl)ethanamine;hydrochloride
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1-(2-fluorophenyl)-2,2-dimethylpropane-1,3-diamine
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2,2,3-trifluoro-3-(2-fluorophenyl)propanoic acid
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(3S)-3-amino-3-(2-fluorophenyl)-2,2-dimethylpropan-1-ol;hydrochloride
CID 171239204
1-(2-fluorophenyl)-2-methyl-2-phenylpropan-1-ol
CID 55180552
1-fluoro-2-[(2R)-3-methylbutan-2-yl]benzene
CID 138464950
1-(2-fluorophenyl)propan-1-amine
CID 18439474
1-fluoro-1-(2-fluorophenyl)propan-2-ol
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CID 79198458

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine?
The IUPAC name of 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine (CID 83853539) is 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine.
What is the SMILES notation for 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine?
The canonical SMILES for 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine is CC(C)(N)C(F)c1ccccc1F.
What is the InChIKey of 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine?
The InChIKey is AHASLMYDUXYDGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13F2N/c1-10(2,13)9(12)7-5-3-4-6-8(7)11/h3-6,9H,13H2,1-2H3.
What are the key properties of 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine?
1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine has a molecular weight of 185.22 g/mol, XLogP of 2.57, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-1-(2-fluorophenyl)-2-methylpropan-2-amine is sourced from PubChem (CID 83853539), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).