N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide

C12H16FNO2 — CID 102990501

IUPACN-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide
SMILESCCNC(=O)C(C)Oc1cc(F)ccc1C
InChIInChI=1S/C12H16FNO2/c1-4-14-12(15)9(3)16-11-7-10(13)6-5-8(11)2/h5-7,9H,4H2,1-3H3,(H,14,15)
InChIKeyDCDHDRRBFZGFFJ-UHFFFAOYSA-N
MW225.26 g/mol
LogP2.04
Rot. Bonds4

About N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide

N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide (PubChem CID 102990501) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide.

Molecular Properties

Compound NameN-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide
PubChem CID102990501
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC NameN-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide
SMILESCCNC(=O)C(C)Oc1cc(F)ccc1C
InChIInChI=1S/C12H16FNO2/c1-4-14-12(15)9(3)16-11-7-10(13)6-5-8(11)2/h5-7,9H,4H2,1-3H3,(H,14,15)
InChIKeyDCDHDRRBFZGFFJ-UHFFFAOYSA-N
XLogP2.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl (2S)-2-(5-fluoro-2-methylphenoxy)propanoate
CID 103338283
(2S)-N-butyl-2-(2,5-difluorophenoxy)propanamide
CID 95973725
2-[4-fluoro-2-(hydroxymethyl)phenoxy]-N-propylpropanamide
CID 107698502
2-(2-bromo-5-fluorophenoxy)-N-pentylpropanamide
CID 81495069
(2R)-N-ethyl-2-(2,3,5-trimethylphenoxy)propanamide
CID 28631725
N-ethyl-2-(2-hydroxyphenoxy)propanamide
CID 43143422
2-(2,5-dimethylphenoxy)-N-[6-[2-(2,5-dimethylphenoxy)propanoylamino]hexyl]propanamide
CID 4945104
4-[1-(ethylamino)-1-oxopropan-2-yl]oxy-3-methylbenzoic acid
CID 107673535
N-[2-(ethylamino)ethyl]-2-(2-methyl-5-propan-2-ylphenoxy)propanamide;hydrochloride
CID 119508717
2-(5-amino-2-methylphenoxy)-N-(ethylcarbamoyl)propanamide
CID 43520156
2-(2-amino-5-fluorophenoxy)-N-(2-methylpropyl)propanamide
CID 43116075
1-[[(2R)-2-(2,4-difluorophenoxy)propanoyl]amino]-3-ethylthiourea
CID 40633643

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide?
The IUPAC name of N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide (CID 102990501) is N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide.
What is the SMILES notation for N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide?
The canonical SMILES for N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide is CCNC(=O)C(C)Oc1cc(F)ccc1C.
What is the InChIKey of N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide?
The InChIKey is DCDHDRRBFZGFFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c1-4-14-12(15)9(3)16-11-7-10(13)6-5-8(11)2/h5-7,9H,4H2,1-3H3,(H,14,15).
What are the key properties of N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide?
N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide has a molecular weight of 225.26 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(5-fluoro-2-methylphenoxy)propanamide is sourced from PubChem (CID 102990501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).