2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol

C8H16FNO — CID 80693751

IUPAC2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol
SMILESOC1CCCC1CNCCF
InChIInChI=1S/C8H16FNO/c9-4-5-10-6-7-2-1-3-8(7)11/h7-8,10-11H,1-6H2
InChIKeyXLIFDKOEZNOUTL-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.71
Rot. Bonds4

About 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol

2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol (PubChem CID 80693751) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol
PubChem CID80693751
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol
SMILESOC1CCCC1CNCCF
InChIInChI=1S/C8H16FNO/c9-4-5-10-6-7-2-1-3-8(7)11/h7-8,10-11H,1-6H2
InChIKeyXLIFDKOEZNOUTL-UHFFFAOYSA-N
XLogP0.71
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.22
LogP ≤ 50.71
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]cyclopentan-1-ol?
The IUPAC name of 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol (CID 80693751) is 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol is OC1CCCC1CNCCF.
What is the InChIKey of 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol?
The InChIKey is XLIFDKOEZNOUTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c9-4-5-10-6-7-2-1-3-8(7)11/h7-8,10-11H,1-6H2.
What are the key properties of 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol?
2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol has a molecular weight of 161.22 g/mol, XLogP of 0.71, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluoroethylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 80693751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).