2-fluoro-N-(4-propan-2-ylphenyl)aniline

C15H16FN — CID 155290026

IUPAC2-fluoro-N-(4-propan-2-ylphenyl)aniline
SMILESCC(C)c1ccc(Nc2ccccc2F)cc1
InChIInChI=1S/C15H16FN/c1-11(2)12-7-9-13(10-8-12)17-15-6-4-3-5-14(15)16/h3-11,17H,1-2H3
InChIKeyFEYMQCDRCDFUEQ-UHFFFAOYSA-N
MW229.30 g/mol
LogP4.69
Rot. Bonds3

About 2-fluoro-N-(4-propan-2-ylphenyl)aniline

2-fluoro-N-(4-propan-2-ylphenyl)aniline (PubChem CID 155290026) has the molecular formula C15H16FN and a molecular weight of 229.30 g/mol. Its IUPAC name is 2-fluoro-N-(4-propan-2-ylphenyl)aniline.

Molecular Properties

Compound Name2-fluoro-N-(4-propan-2-ylphenyl)aniline
PubChem CID155290026
Molecular FormulaC15H16FN
Molecular Weight229.30 g/mol
Exact Mass229.13
IUPAC Name2-fluoro-N-(4-propan-2-ylphenyl)aniline
SMILESCC(C)c1ccc(Nc2ccccc2F)cc1
InChIInChI=1S/C15H16FN/c1-11(2)12-7-9-13(10-8-12)17-15-6-4-3-5-14(15)16/h3-11,17H,1-2H3
InChIKeyFEYMQCDRCDFUEQ-UHFFFAOYSA-N
XLogP4.69
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.30
LogP ≤ 54.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-N-(2-fluorophenyl)-1-N-methylbenzene-1,4-diamine
CID 117027231
1-N,4-N-bis(4-propan-2-ylphenyl)benzene-1,4-diamine
CID 71359938
3-(4-propan-2-ylanilino)benzene-1,2-diol
CID 171920166
N-(2-fluorophenyl)-5-(4-propan-2-ylanilino)pyrazine-2-carboxamide
CID 109292042
N-(2-fluorophenyl)-1-(4-propan-2-ylphenyl)ethane-1,2-diamine
CID 65378148
6-(2-fluoroanilino)-N-(4-propan-2-ylphenyl)pyrimidine-4-carboxamide
CID 109357645
N-(4-chlorophenyl)-2-propan-2-ylaniline
CID 82536589
2,3-difluoro-4-(4-propan-2-ylanilino)benzonitrile
CID 107933203
N-[(2-fluorophenyl)methyl]-4-propan-2-ylaniline
CID 28551331
4-(2-fluoroanilino)benzoic acid
CID 62231206
cumene;N-phenylaniline
CID 22645781
2-N-(2-fluorophenyl)-1-N-(3-methylbutyl)benzene-1,2-diamine
CID 19043346

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(4-propan-2-ylphenyl)aniline?
The IUPAC name of 2-fluoro-N-(4-propan-2-ylphenyl)aniline (CID 155290026) is 2-fluoro-N-(4-propan-2-ylphenyl)aniline.
What is the SMILES notation for 2-fluoro-N-(4-propan-2-ylphenyl)aniline?
The canonical SMILES for 2-fluoro-N-(4-propan-2-ylphenyl)aniline is CC(C)c1ccc(Nc2ccccc2F)cc1.
What is the InChIKey of 2-fluoro-N-(4-propan-2-ylphenyl)aniline?
The InChIKey is FEYMQCDRCDFUEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16FN/c1-11(2)12-7-9-13(10-8-12)17-15-6-4-3-5-14(15)16/h3-11,17H,1-2H3.
What are the key properties of 2-fluoro-N-(4-propan-2-ylphenyl)aniline?
2-fluoro-N-(4-propan-2-ylphenyl)aniline has a molecular weight of 229.30 g/mol, XLogP of 4.69, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(4-propan-2-ylphenyl)aniline is sourced from PubChem (CID 155290026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).