2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol

C18H20FNO — CID 43635434

IUPAC2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol
SMILESOC(CNC1CC(c2ccc(F)cc2)C1)c1ccccc1
InChIInChI=1S/C18H20FNO/c19-16-8-6-13(7-9-16)15-10-17(11-15)20-12-18(21)14-4-2-1-3-5-14/h1-9,15,17-18,20-21H,10-12H2
InChIKeyIHFDZARJZFVDEU-UHFFFAOYSA-N
MW285.36 g/mol
LogP3.39
Rot. Bonds5

About 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol

2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol (PubChem CID 43635434) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol.

Molecular Properties

Compound Name2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol
PubChem CID43635434
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC Name2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol
SMILESOC(CNC1CC(c2ccc(F)cc2)C1)c1ccccc1
InChIInChI=1S/C18H20FNO/c19-16-8-6-13(7-9-16)15-10-17(11-15)20-12-18(21)14-4-2-1-3-5-14/h1-9,15,17-18,20-21H,10-12H2
InChIKeyIHFDZARJZFVDEU-UHFFFAOYSA-N
XLogP3.39
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-[[3-(4-fluorophenyl)cyclobutyl]amino]-2-phenylethanol
CID 63182164
N-(2,3-dimethylbutyl)-3-(4-fluorophenyl)cyclobutan-1-amine
CID 64568470
2-[[3-(4-fluorophenyl)cyclobutyl]amino]acetic acid
CID 43635152
3-(4-fluorophenyl)-N-(2,3,3-trimethylbutyl)cyclobutan-1-amine
CID 83143109
(1R)-2-(2,3-dihydro-1H-inden-2-ylamino)-1-phenylethanol
CID 6926815
(1R)-2-[(4-fluorophenyl)methylamino]-1-phenylethanol
CID 6926807
N-[2-(4-fluorophenyl)ethyl]-3-phenylcyclobutan-1-amine
CID 43632093
1-(4-fluorophenyl)-2-[(2-methylcyclopropyl)amino]ethanol
CID 62397151
1-(4-fluorophenyl)-2-[(1-oxothian-4-yl)amino]ethanol
CID 113479901
3-(4-fluorophenyl)-N-(2,2,3,3-tetrafluoropropyl)cyclobutan-1-amine
CID 103529409
(2R)-2-[[3-(4-fluorophenyl)cyclobutyl]amino]-3-phenylpropanoic acid
CID 122037960
4-[[2-(4-fluorophenyl)-2-hydroxyethyl]amino]pyrrolidin-2-one
CID 106189351

Frequently Asked Questions

What is the IUPAC name of 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol?
The IUPAC name of 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol (CID 43635434) is 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol.
What is the SMILES notation for 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol?
The canonical SMILES for 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol is OC(CNC1CC(c2ccc(F)cc2)C1)c1ccccc1.
What is the InChIKey of 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol?
The InChIKey is IHFDZARJZFVDEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO/c19-16-8-6-13(7-9-16)15-10-17(11-15)20-12-18(21)14-4-2-1-3-5-14/h1-9,15,17-18,20-21H,10-12H2.
What are the key properties of 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol?
2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol has a molecular weight of 285.36 g/mol, XLogP of 3.39, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[3-(4-fluorophenyl)cyclobutyl]amino]-1-phenylethanol is sourced from PubChem (CID 43635434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).