[1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol

C16H24FNO — CID 81419006

IUPAC[1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol
SMILESCC(NCC1(CO)CCCCC1)c1ccccc1F
InChIInChI=1S/C16H24FNO/c1-13(14-7-3-4-8-15(14)17)18-11-16(12-19)9-5-2-6-10-16/h3-4,7-8,13,18-19H,2,5-6,9-12H2,1H3
InChIKeyPRKYIQQMRILDOM-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.42
Rot. Bonds5

About [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol

[1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol (PubChem CID 81419006) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol
PubChem CID81419006
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name[1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol
SMILESCC(NCC1(CO)CCCCC1)c1ccccc1F
InChIInChI=1S/C16H24FNO/c1-13(14-7-3-4-8-15(14)17)18-11-16(12-19)9-5-2-6-10-16/h3-4,7-8,13,18-19H,2,5-6,9-12H2,1H3
InChIKeyPRKYIQQMRILDOM-UHFFFAOYSA-N
XLogP3.42
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.37
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-[[1-(2,3-difluorophenyl)ethylamino]methyl]cyclohexyl]methanol
CID 103924886
[1-[[1-(2-chlorophenyl)ethylamino]methyl]cyclohexyl]methanol
CID 79985726
[1-[[[(1S)-1-(2-methoxyphenyl)ethyl]amino]methyl]cyclohexyl]methanol
CID 81419393
5-fluoro-2-[1-[[1-(hydroxymethyl)cyclopentyl]methylamino]ethyl]phenol
CID 115358531
[1-[[1-[2-(difluoromethoxy)phenyl]ethylamino]methyl]cyclopropyl]methanol
CID 81344008
[4-[[[(1R)-1-(2-fluorophenyl)propyl]amino]methyl]oxan-4-yl]methanol
CID 99820181
[1-[[1-(3-chloro-4-fluorophenyl)ethylamino]methyl]cyclopentyl]methanol
CID 115358450
4-ethyl-1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexan-1-ol
CID 65116270
[1-[[[(1R)-1-pyridin-4-ylethyl]amino]methyl]cyclohexyl]methanol
CID 81419096
3-[1-[[1-(hydroxymethyl)cyclohexyl]methylamino]ethyl]phenol
CID 81412551
[1-[[(2-methyl-1-phenylpropyl)amino]methyl]cyclopentyl]methanol
CID 115358847
[1-[[1-(5-methylfuran-2-yl)ethylamino]methyl]cyclohexyl]methanol
CID 81412663

Frequently Asked Questions

What is the IUPAC name of [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol?
The IUPAC name of [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol (CID 81419006) is [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol.
What is the SMILES notation for [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol?
The canonical SMILES for [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol is CC(NCC1(CO)CCCCC1)c1ccccc1F.
What is the InChIKey of [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol?
The InChIKey is PRKYIQQMRILDOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-13(14-7-3-4-8-15(14)17)18-11-16(12-19)9-5-2-6-10-16/h3-4,7-8,13,18-19H,2,5-6,9-12H2,1H3.
What are the key properties of [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol?
[1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol has a molecular weight of 265.37 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[[1-(2-fluorophenyl)ethylamino]methyl]cyclohexyl]methanol is sourced from PubChem (CID 81419006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).