N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide

C13H16FNO2 — CID 60729344

IUPACN-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide
SMILESCCN(C(=O)COc1cccc(F)c1)C1CC1
InChIInChI=1S/C13H16FNO2/c1-2-15(11-6-7-11)13(16)9-17-12-5-3-4-10(14)8-12/h3-5,8,11H,2,6-7,9H2,1H3
InChIKeyFTQZGHSGTIGNFK-UHFFFAOYSA-N
MW237.27 g/mol
LogP2.22
Rot. Bonds5

About N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide

N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide (PubChem CID 60729344) has the molecular formula C13H16FNO2 and a molecular weight of 237.27 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide
PubChem CID60729344
Molecular FormulaC13H16FNO2
Molecular Weight237.27 g/mol
Exact Mass237.12
IUPAC NameN-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide
SMILESCCN(C(=O)COc1cccc(F)c1)C1CC1
InChIInChI=1S/C13H16FNO2/c1-2-15(11-6-7-11)13(16)9-17-12-5-3-4-10(14)8-12/h3-5,8,11H,2,6-7,9H2,1H3
InChIKeyFTQZGHSGTIGNFK-UHFFFAOYSA-N
XLogP2.22
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.27
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[3-(aminomethyl)phenoxy]-N-cyclopropyl-N-ethylacetamide
CID 61487869
N-cyclopropyl-N-ethyl-2-(4-fluoro-3-methylphenoxy)acetamide
CID 81421978
N-cyclopropyl-N-ethyl-2-[3-(ethylaminomethyl)phenoxy]acetamide
CID 61488014
N-cyclopropyl-2-(3-fluorophenoxy)-N-[(2-methyl-1,3-thiazol-4-yl)methyl]acetamide
CID 110718310
N-(1,1-dioxothiolan-3-yl)-2-(3-fluorophenoxy)-N-methylacetamide
CID 110755800
2-[4-(aminomethyl)phenoxy]-N-cyclopropyl-N-ethylacetamide
CID 43263738
methyl 2-[ethyl-[2-(3-fluorophenoxy)acetyl]amino]acetate
CID 54979676
N-cyclopropyl-N-ethyl-2-[5-fluoro-2-[(1S)-1-hydroxyethyl]phenoxy]acetamide
CID 78932476
N-benzyl-N-(1,1-dioxothiolan-3-yl)-2-(3-fluorophenoxy)acetamide
CID 42887730
2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-cyclopropyl-N-ethylacetamide
CID 107700484
2-(3-fluorophenoxy)-N-methyl-N-phenylacetamide
CID 78762284
N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide
CID 64854538

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide?
The IUPAC name of N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide (CID 60729344) is N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide is CCN(C(=O)COc1cccc(F)c1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide?
The InChIKey is FTQZGHSGTIGNFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16FNO2/c1-2-15(11-6-7-11)13(16)9-17-12-5-3-4-10(14)8-12/h3-5,8,11H,2,6-7,9H2,1H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide?
N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide has a molecular weight of 237.27 g/mol, XLogP of 2.22, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-ethyl-2-(3-fluorophenoxy)acetamide is sourced from PubChem (CID 60729344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).