2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol

C16H18FNO — CID 61047955

IUPAC2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol
SMILESCc1ccccc1C(C)(CO)Nc1ccc(F)cc1
InChIInChI=1S/C16H18FNO/c1-12-5-3-4-6-15(12)16(2,11-19)18-14-9-7-13(17)8-10-14/h3-10,18-19H,11H2,1-2H3
InChIKeyIMLSTDFQRXFVER-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.45
Rot. Bonds4

About 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol

2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol (PubChem CID 61047955) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol.

Molecular Properties

Compound Name2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol
PubChem CID61047955
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol
SMILESCc1ccccc1C(C)(CO)Nc1ccc(F)cc1
InChIInChI=1S/C16H18FNO/c1-12-5-3-4-6-15(12)16(2,11-19)18-14-9-7-13(17)8-10-14/h3-10,18-19H,11H2,1-2H3
InChIKeyIMLSTDFQRXFVER-UHFFFAOYSA-N
XLogP3.45
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-fluoroanilino)-2-(2-fluorophenyl)propan-1-ol
CID 61048560
2-(4-fluoroanilino)-2-(2,4,6-trimethylphenyl)propan-1-ol
CID 61048556
2-(3-bromoanilino)-2-(2-methylphenyl)propan-1-ol
CID 61048061
2-(2-bromophenyl)-2-(3-fluoro-5-methylanilino)propan-1-ol
CID 79049467
2-(4-bromoanilino)-2-(2-methoxyphenyl)propan-1-ol
CID 61049055
2-(5-bromofuran-2-yl)-2-(4-fluoroanilino)propan-1-ol
CID 113437691
2-[4-(dimethylamino)phenyl]-2-(4-fluoroanilino)propan-1-ol
CID 61050347
2-(4-fluoroanilino)-2-methylbutan-1-ol
CID 61050548
2-(2-methylphenyl)-2-(propylamino)propan-1-ol
CID 61055182
2-(2,4-difluorophenyl)-2-(4-methoxyanilino)propan-1-ol
CID 61045474
2-anilino-2-(2,6-difluorophenyl)propan-1-ol
CID 61046430
2-(4-fluoroanilino)-2-(1,3-thiazol-2-yl)propan-1-ol
CID 64991044

Frequently Asked Questions

What is the IUPAC name of 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol?
The IUPAC name of 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol (CID 61047955) is 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol.
What is the SMILES notation for 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol?
The canonical SMILES for 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol is Cc1ccccc1C(C)(CO)Nc1ccc(F)cc1.
What is the InChIKey of 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol?
The InChIKey is IMLSTDFQRXFVER-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-12-5-3-4-6-15(12)16(2,11-19)18-14-9-7-13(17)8-10-14/h3-10,18-19H,11H2,1-2H3.
What are the key properties of 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol?
2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol has a molecular weight of 259.32 g/mol, XLogP of 3.45, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-fluoroanilino)-2-(2-methylphenyl)propan-1-ol is sourced from PubChem (CID 61047955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).