N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide

C12H17FN2O — CID 103604204

IUPACN-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide
SMILESCC(=O)NCCNCCc1ccccc1F
InChIInChI=1S/C12H17FN2O/c1-10(16)15-9-8-14-7-6-11-4-2-3-5-12(11)13/h2-5,14H,6-9H2,1H3,(H,15,16)
InChIKeyFHRZOKXROBULHP-UHFFFAOYSA-N
MW224.28 g/mol
LogP1.09
Rot. Bonds6

About N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide

N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide (PubChem CID 103604204) has the molecular formula C12H17FN2O and a molecular weight of 224.28 g/mol. Its IUPAC name is N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide.

Molecular Properties

Compound NameN-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide
PubChem CID103604204
Molecular FormulaC12H17FN2O
Molecular Weight224.28 g/mol
Exact Mass224.13
IUPAC NameN-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide
SMILESCC(=O)NCCNCCc1ccccc1F
InChIInChI=1S/C12H17FN2O/c1-10(16)15-9-8-14-7-6-11-4-2-3-5-12(11)13/h2-5,14H,6-9H2,1H3,(H,15,16)
InChIKeyFHRZOKXROBULHP-UHFFFAOYSA-N
XLogP1.09
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.28
LogP ≤ 51.09
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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Related Compounds

1-[2-(2-fluorophenyl)ethylamino]propan-2-one
CID 115235072
N-(4-acetamidobutyl)-4-(2-fluorophenyl)butanamide
CID 110609858
N-[2-[(3-fluoro-2-hydroxyphenyl)methylamino]ethyl]acetamide
CID 112606322
N-(3-acetamidopropyl)-2-(2-fluorophenyl)acetamide
CID 38450332
ethane;N-[2-(2-fluorophenyl)ethyl]propan-1-amine
CID 155737133
N-[2-(2-fluorophenyl)ethyl]propanamide
CID 22380876
N-[2-[(2,6-difluorophenyl)methylamino]ethyl]acetamide
CID 28684466
(Z)-4-[2-(2-fluorophenyl)ethylamino]-3-methylbut-2-enoic acid
CID 103233396
3-[2-(2-fluorophenyl)ethylamino]-N-(2-methoxyethyl)propanamide
CID 109015003
2-(2-fluorophenyl)-N-[2-(2-fluorophenyl)ethyl]acetamide
CID 78792118
ethane;N-ethyl-2-(2-fluorophenyl)ethanamine
CID 155737119
N'-[2-(2-fluorophenyl)ethyl]-N-methylmethanediamine
CID 115227243

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide?
The IUPAC name of N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide (CID 103604204) is N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide.
What is the SMILES notation for N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide?
The canonical SMILES for N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide is CC(=O)NCCNCCc1ccccc1F.
What is the InChIKey of N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide?
The InChIKey is FHRZOKXROBULHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17FN2O/c1-10(16)15-9-8-14-7-6-11-4-2-3-5-12(11)13/h2-5,14H,6-9H2,1H3,(H,15,16).
What are the key properties of N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide?
N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide has a molecular weight of 224.28 g/mol, XLogP of 1.09, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2-fluorophenyl)ethylamino]ethyl]acetamide is sourced from PubChem (CID 103604204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).