2-ethyl-1-fluoro-N-methylcyclopentan-1-amine

C8H16FN — CID 171512621

IUPAC2-ethyl-1-fluoro-N-methylcyclopentan-1-amine
SMILESCCC1CCCC1(F)NC
InChIInChI=1S/C8H16FN/c1-3-7-5-4-6-8(7,9)10-2/h7,10H,3-6H2,1-2H3
InChIKeyQHMRXICSZDFKRZ-UHFFFAOYSA-N
MW145.22 g/mol
LogP2.08
Rot. Bonds2

About 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine

2-ethyl-1-fluoro-N-methylcyclopentan-1-amine (PubChem CID 171512621) has the molecular formula C8H16FN and a molecular weight of 145.22 g/mol. Its IUPAC name is 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine.

Molecular Properties

Compound Name2-ethyl-1-fluoro-N-methylcyclopentan-1-amine
PubChem CID171512621
Molecular FormulaC8H16FN
Molecular Weight145.22 g/mol
Exact Mass145.13
IUPAC Name2-ethyl-1-fluoro-N-methylcyclopentan-1-amine
SMILESCCC1CCCC1(F)NC
InChIInChI=1S/C8H16FN/c1-3-7-5-4-6-8(7,9)10-2/h7,10H,3-6H2,1-2H3
InChIKeyQHMRXICSZDFKRZ-UHFFFAOYSA-N
XLogP2.08
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.22
LogP ≤ 52.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine?
The IUPAC name of 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine (CID 171512621) is 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine.
What is the SMILES notation for 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine?
The canonical SMILES for 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine is CCC1CCCC1(F)NC.
What is the InChIKey of 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine?
The InChIKey is QHMRXICSZDFKRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16FN/c1-3-7-5-4-6-8(7,9)10-2/h7,10H,3-6H2,1-2H3.
What are the key properties of 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine?
2-ethyl-1-fluoro-N-methylcyclopentan-1-amine has a molecular weight of 145.22 g/mol, XLogP of 2.08, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-fluoro-N-methylcyclopentan-1-amine is sourced from PubChem (CID 171512621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).