N-[2-(2-fluoroethylamino)ethyl]formamide

C5H11FN2O — CID 87509270

IUPACN-[2-(2-fluoroethylamino)ethyl]formamide
SMILESO=CNCCNCCF
InChIInChI=1S/C5H11FN2O/c6-1-2-7-3-4-8-5-9/h5,7H,1-4H2,(H,8,9)
InChIKeyAKHUUYKTULFNQR-UHFFFAOYSA-N
MW134.15 g/mol
LogP-0.71
Rot. Bonds6

About N-[2-(2-fluoroethylamino)ethyl]formamide

N-[2-(2-fluoroethylamino)ethyl]formamide (PubChem CID 87509270) has the molecular formula C5H11FN2O and a molecular weight of 134.15 g/mol. Its IUPAC name is N-[2-(2-fluoroethylamino)ethyl]formamide.

Molecular Properties

Compound NameN-[2-(2-fluoroethylamino)ethyl]formamide
PubChem CID87509270
Molecular FormulaC5H11FN2O
Molecular Weight134.15 g/mol
Exact Mass134.09
IUPAC NameN-[2-(2-fluoroethylamino)ethyl]formamide
SMILESO=CNCCNCCF
InChIInChI=1S/C5H11FN2O/c6-1-2-7-3-4-8-5-9/h5,7H,1-4H2,(H,8,9)
InChIKeyAKHUUYKTULFNQR-UHFFFAOYSA-N
XLogP-0.71
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.15
LogP ≤ 5-0.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluoroethylamino)ethyl]formamide?
The IUPAC name of N-[2-(2-fluoroethylamino)ethyl]formamide (CID 87509270) is N-[2-(2-fluoroethylamino)ethyl]formamide.
What is the SMILES notation for N-[2-(2-fluoroethylamino)ethyl]formamide?
The canonical SMILES for N-[2-(2-fluoroethylamino)ethyl]formamide is O=CNCCNCCF.
What is the InChIKey of N-[2-(2-fluoroethylamino)ethyl]formamide?
The InChIKey is AKHUUYKTULFNQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11FN2O/c6-1-2-7-3-4-8-5-9/h5,7H,1-4H2,(H,8,9).
What are the key properties of N-[2-(2-fluoroethylamino)ethyl]formamide?
N-[2-(2-fluoroethylamino)ethyl]formamide has a molecular weight of 134.15 g/mol, XLogP of -0.71, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluoroethylamino)ethyl]formamide is sourced from PubChem (CID 87509270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).