[2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol

C16H24FNO — CID 102612788

IUPAC[2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol
SMILESCCC(NC1CCCCC1CO)c1cccc(F)c1
InChIInChI=1S/C16H24FNO/c1-2-15(12-7-5-8-14(17)10-12)18-16-9-4-3-6-13(16)11-19/h5,7-8,10,13,15-16,18-19H,2-4,6,9,11H2,1H3
InChIKeyFLVQAENMSYGFSQ-UHFFFAOYSA-N
MW265.37 g/mol
LogP3.42
Rot. Bonds5

About [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol

[2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol (PubChem CID 102612788) has the molecular formula C16H24FNO and a molecular weight of 265.37 g/mol. Its IUPAC name is [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol
PubChem CID102612788
Molecular FormulaC16H24FNO
Molecular Weight265.37 g/mol
Exact Mass265.18
IUPAC Name[2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol
SMILESCCC(NC1CCCCC1CO)c1cccc(F)c1
InChIInChI=1S/C16H24FNO/c1-2-15(12-7-5-8-14(17)10-12)18-16-9-4-3-6-13(16)11-19/h5,7-8,10,13,15-16,18-19H,2-4,6,9,11H2,1H3
InChIKeyFLVQAENMSYGFSQ-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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Frequently Asked Questions

What is the IUPAC name of [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol?
The IUPAC name of [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol (CID 102612788) is [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol.
What is the SMILES notation for [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol?
The canonical SMILES for [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol is CCC(NC1CCCCC1CO)c1cccc(F)c1.
What is the InChIKey of [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol?
The InChIKey is FLVQAENMSYGFSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24FNO/c1-2-15(12-7-5-8-14(17)10-12)18-16-9-4-3-6-13(16)11-19/h5,7-8,10,13,15-16,18-19H,2-4,6,9,11H2,1H3.
What are the key properties of [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol?
[2-[1-(3-fluorophenyl)propylamino]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 [2-[1-(3-fluorophenyl)propylamino]cyclohexyl]methanol is sourced from PubChem (CID 102612788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).