[4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol

C16H18FNO — CID 114830703

IUPAC[4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol
SMILESCC(Cc1ccccc1F)Nc1ccc(CO)cc1
InChIInChI=1S/C16H18FNO/c1-12(10-14-4-2-3-5-16(14)17)18-15-8-6-13(11-19)7-9-15/h2-9,12,18-19H,10-11H2,1H3
InChIKeyBZKYPZBTSNXULX-UHFFFAOYSA-N
MW259.32 g/mol
LogP3.36
Rot. Bonds5

About [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol

[4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol (PubChem CID 114830703) has the molecular formula C16H18FNO and a molecular weight of 259.32 g/mol. Its IUPAC name is [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol.

Molecular Properties

Compound Name[4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol
PubChem CID114830703
Molecular FormulaC16H18FNO
Molecular Weight259.32 g/mol
Exact Mass259.14
IUPAC Name[4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol
SMILESCC(Cc1ccccc1F)Nc1ccc(CO)cc1
InChIInChI=1S/C16H18FNO/c1-12(10-14-4-2-3-5-16(14)17)18-15-8-6-13(11-19)7-9-15/h2-9,12,18-19H,10-11H2,1H3
InChIKeyBZKYPZBTSNXULX-UHFFFAOYSA-N
XLogP3.36
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.32
LogP ≤ 53.36
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]acetamide
CID 114827852
N-[1-(2-fluorophenyl)propan-2-yl]-4-propan-2-yloxyaniline
CID 114828418
4-(difluoromethoxy)-N-[1-(2-fluorophenyl)propan-2-yl]aniline
CID 114828280
3-chloro-N-[1-(2-fluorophenyl)propan-2-yl]-4-methylaniline
CID 114827877
N-[1-(2-fluorophenyl)propan-2-yl]-3-iodoaniline
CID 114828426
3-[1-(2-fluorophenyl)propan-2-ylamino]butan-1-ol
CID 115976612
3-fluoro-N-[1-(2-fluorophenyl)propan-2-yl]-4-nitroaniline
CID 114830485
2-fluoro-N-[1-(2-fluorophenyl)propan-2-yl]-6-methylaniline
CID 114830872
N-[(2S)-1-(2-fluorophenyl)propan-2-yl]-1-propylpyrazol-4-amine
CID 99825558
N-[1-(2-fluorophenyl)propan-2-yl]acetamide
CID 91692173
2-tert-butyl-N-[1-(2-fluorophenyl)propan-2-yl]aniline
CID 114828604
2,5-difluoro-N-[1-(2-fluorophenyl)propan-2-yl]aniline
CID 114828016

Frequently Asked Questions

What is the IUPAC name of [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol?
The IUPAC name of [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol (CID 114830703) is [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol.
What is the SMILES notation for [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol?
The canonical SMILES for [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol is CC(Cc1ccccc1F)Nc1ccc(CO)cc1.
What is the InChIKey of [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol?
The InChIKey is BZKYPZBTSNXULX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FNO/c1-12(10-14-4-2-3-5-16(14)17)18-15-8-6-13(11-19)7-9-15/h2-9,12,18-19H,10-11H2,1H3.
What are the key properties of [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol?
[4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol has a molecular weight of 259.32 g/mol, XLogP of 3.36, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[1-(2-fluorophenyl)propan-2-ylamino]phenyl]methanol is sourced from PubChem (CID 114830703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).