N-cyclopropyl-2-(2-fluoroethylamino)acetamide

C7H13FN2O — CID 80694182

IUPACN-cyclopropyl-2-(2-fluoroethylamino)acetamide
SMILESO=C(CNCCF)NC1CC1
InChIInChI=1S/C7H13FN2O/c8-3-4-9-5-7(11)10-6-1-2-6/h6,9H,1-5H2,(H,10,11)
InChIKeyYZWYZLYPXDKZBS-UHFFFAOYSA-N
MW160.19 g/mol
LogP-0.18
Rot. Bonds5

About N-cyclopropyl-2-(2-fluoroethylamino)acetamide

N-cyclopropyl-2-(2-fluoroethylamino)acetamide (PubChem CID 80694182) has the molecular formula C7H13FN2O and a molecular weight of 160.19 g/mol. Its IUPAC name is N-cyclopropyl-2-(2-fluoroethylamino)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2-fluoroethylamino)acetamide
PubChem CID80694182
Molecular FormulaC7H13FN2O
Molecular Weight160.19 g/mol
Exact Mass160.10
IUPAC NameN-cyclopropyl-2-(2-fluoroethylamino)acetamide
SMILESO=C(CNCCF)NC1CC1
InChIInChI=1S/C7H13FN2O/c8-3-4-9-5-7(11)10-6-1-2-6/h6,9H,1-5H2,(H,10,11)
InChIKeyYZWYZLYPXDKZBS-UHFFFAOYSA-N
XLogP-0.18
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.19
LogP ≤ 5-0.18
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 N-cyclopropyl-2-(2-fluoroethylamino)acetamide?
The IUPAC name of N-cyclopropyl-2-(2-fluoroethylamino)acetamide (CID 80694182) is N-cyclopropyl-2-(2-fluoroethylamino)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2-fluoroethylamino)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2-fluoroethylamino)acetamide is O=C(CNCCF)NC1CC1.
What is the InChIKey of N-cyclopropyl-2-(2-fluoroethylamino)acetamide?
The InChIKey is YZWYZLYPXDKZBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13FN2O/c8-3-4-9-5-7(11)10-6-1-2-6/h6,9H,1-5H2,(H,10,11).
What are the key properties of N-cyclopropyl-2-(2-fluoroethylamino)acetamide?
N-cyclopropyl-2-(2-fluoroethylamino)acetamide has a molecular weight of 160.19 g/mol, XLogP of -0.18, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2-fluoroethylamino)acetamide is sourced from PubChem (CID 80694182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).