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

C8H16FNO — CID 80694379

IUPAC1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNCCF)CCCC1
InChIInChI=1S/C8H16FNO/c9-5-6-10-7-8(11)3-1-2-4-8/h10-11H,1-7H2
InChIKeyOXUGTIHVYVAJAJ-UHFFFAOYSA-N
MW161.22 g/mol
LogP0.85
Rot. Bonds4

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

1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol (PubChem CID 80694379) has the molecular formula C8H16FNO and a molecular weight of 161.22 g/mol. Its IUPAC name is 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol
PubChem CID80694379
Molecular FormulaC8H16FNO
Molecular Weight161.22 g/mol
Exact Mass161.12
IUPAC Name1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol
SMILESOC1(CNCCF)CCCC1
InChIInChI=1S/C8H16FNO/c9-5-6-10-7-8(11)3-1-2-4-8/h10-11H,1-7H2
InChIKeyOXUGTIHVYVAJAJ-UHFFFAOYSA-N
XLogP0.85
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 ≤ 50.85
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 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol?
The IUPAC name of 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol (CID 80694379) is 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol.
What is the SMILES notation for 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol?
The canonical SMILES for 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol is OC1(CNCCF)CCCC1.
What is the InChIKey of 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol?
The InChIKey is OXUGTIHVYVAJAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FNO/c9-5-6-10-7-8(11)3-1-2-4-8/h10-11H,1-7H2.
What are the key properties of 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol?
1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol has a molecular weight of 161.22 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluoroethylamino)methyl]cyclopentan-1-ol is sourced from PubChem (CID 80694379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).