[2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol

C10H20FNO — CID 80693888

IUPAC[2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol
SMILESOCC1CCCCC1CNCCF
InChIInChI=1S/C10H20FNO/c11-5-6-12-7-9-3-1-2-4-10(9)8-13/h9-10,12-13H,1-8H2
InChIKeyWXUAYOBRQWPLIS-UHFFFAOYSA-N
MW189.27 g/mol
LogP1.34
Rot. Bonds5

About [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol

[2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol (PubChem CID 80693888) has the molecular formula C10H20FNO and a molecular weight of 189.27 g/mol. Its IUPAC name is [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol.

Molecular Properties

Compound Name[2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol
PubChem CID80693888
Molecular FormulaC10H20FNO
Molecular Weight189.27 g/mol
Exact Mass189.15
IUPAC Name[2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol
SMILESOCC1CCCCC1CNCCF
InChIInChI=1S/C10H20FNO/c11-5-6-12-7-9-3-1-2-4-10(9)8-13/h9-10,12-13H,1-8H2
InChIKeyWXUAYOBRQWPLIS-UHFFFAOYSA-N
XLogP1.34
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.27
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol?
The IUPAC name of [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol (CID 80693888) is [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol.
What is the SMILES notation for [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol?
The canonical SMILES for [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol is OCC1CCCCC1CNCCF.
What is the InChIKey of [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol?
The InChIKey is WXUAYOBRQWPLIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20FNO/c11-5-6-12-7-9-3-1-2-4-10(9)8-13/h9-10,12-13H,1-8H2.
What are the key properties of [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol?
[2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol has a molecular weight of 189.27 g/mol, XLogP of 1.34, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-fluoroethylamino)methyl]cyclohexyl]methanol is sourced from PubChem (CID 80693888), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).