N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide

C14H18FNO2 — CID 64854538

IUPACN-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide
SMILESCCN(C(=O)COc1cc(C)ccc1F)C1CC1
InChIInChI=1S/C14H18FNO2/c1-3-16(11-5-6-11)14(17)9-18-13-8-10(2)4-7-12(13)15/h4,7-8,11H,3,5-6,9H2,1-2H3
InChIKeyIQGFHIUAYBUIKN-UHFFFAOYSA-N
MW251.30 g/mol
LogP2.52
Rot. Bonds5

About N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide

N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide (PubChem CID 64854538) has the molecular formula C14H18FNO2 and a molecular weight of 251.30 g/mol. Its IUPAC name is N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide
PubChem CID64854538
Molecular FormulaC14H18FNO2
Molecular Weight251.30 g/mol
Exact Mass251.13
IUPAC NameN-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide
SMILESCCN(C(=O)COc1cc(C)ccc1F)C1CC1
InChIInChI=1S/C14H18FNO2/c1-3-16(11-5-6-11)14(17)9-18-13-8-10(2)4-7-12(13)15/h4,7-8,11H,3,5-6,9H2,1-2H3
InChIKeyIQGFHIUAYBUIKN-UHFFFAOYSA-N
XLogP2.52
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.30
LogP ≤ 52.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-amino-5-methylphenoxy)-N-cyclopropyl-N-ethylacetamide
CID 54957324
2-(2-amino-4-methylphenoxy)-N-cyclopropyl-N-ethylacetamide
CID 54957478
N-cyclopropyl-N-ethyl-2-(4-fluoro-3-methylphenoxy)acetamide
CID 81421978
2-(2-fluoro-5-methylphenoxy)-N,N-dimethylacetamide
CID 64853369
2-(5-bromo-2,3-difluorophenoxy)-N-cyclopropyl-N-ethylacetamide
CID 107098987
2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-cyclopropyl-N-ethylacetamide
CID 107700484
1-(2-fluoro-5-methylphenoxy)propan-2-one
CID 64855614
2-[2-(aminomethyl)-5-chlorophenoxy]-N-cyclopropyl-N-ethylacetamide
CID 114322280
N-(1,1-dioxothiolan-3-yl)-N-ethyl-2-(2-methoxy-4-methylphenoxy)acetamide
CID 112978311
N-cyclopropyl-N-ethyl-2-[5-fluoro-2-[(1S)-1-hydroxyethyl]phenoxy]acetamide
CID 78932476
2-(5-chloro-2-cyanophenoxy)-N-cyclopropyl-N-ethylacetamide
CID 80708889
2-[2-[[(3R)-1,1-dioxothiolan-3-yl]-ethylamino]-2-oxoethoxy]-4-methylbenzoic acid
CID 51515598

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide?
The IUPAC name of N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide (CID 64854538) is N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide.
What is the SMILES notation for N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide?
The canonical SMILES for N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide is CCN(C(=O)COc1cc(C)ccc1F)C1CC1.
What is the InChIKey of N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide?
The InChIKey is IQGFHIUAYBUIKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18FNO2/c1-3-16(11-5-6-11)14(17)9-18-13-8-10(2)4-7-12(13)15/h4,7-8,11H,3,5-6,9H2,1-2H3.
What are the key properties of N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide?
N-cyclopropyl-N-ethyl-2-(2-fluoro-5-methylphenoxy)acetamide has a molecular weight of 251.30 g/mol, XLogP of 2.52, 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-(2-fluoro-5-methylphenoxy)acetamide is sourced from PubChem (CID 64854538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).