N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide

C13H15F2NO3 — CID 43577200

IUPACN-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide
SMILESO=C(COc1ccc(F)cc1F)N(CCO)C1CC1
InChIInChI=1S/C13H15F2NO3/c14-9-1-4-12(11(15)7-9)19-8-13(18)16(5-6-17)10-2-3-10/h1,4,7,10,17H,2-3,5-6,8H2
InChIKeyFLJGSTVIPLOADC-UHFFFAOYSA-N
MW271.26 g/mol
LogP1.33
Rot. Bonds6

About N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide

N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide (PubChem CID 43577200) has the molecular formula C13H15F2NO3 and a molecular weight of 271.26 g/mol. Its IUPAC name is N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound NameN-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide
PubChem CID43577200
Molecular FormulaC13H15F2NO3
Molecular Weight271.26 g/mol
Exact Mass271.10
IUPAC NameN-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide
SMILESO=C(COc1ccc(F)cc1F)N(CCO)C1CC1
InChIInChI=1S/C13H15F2NO3/c14-9-1-4-12(11(15)7-9)19-8-13(18)16(5-6-17)10-2-3-10/h1,4,7,10,17H,2-3,5-6,8H2
InChIKeyFLJGSTVIPLOADC-UHFFFAOYSA-N
XLogP1.33
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.26
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclobutyl-2-(2,4-difluorophenoxy)-N-(3-hydroxypropyl)acetamide
CID 102866483
2-(2,4-difluorophenoxy)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119824020
N-[(3-bromophenyl)methyl]-N-cyclopropyl-2-(2,4-difluorophenoxy)acetamide
CID 55596434
3-[[2-(2-bromo-4-fluorophenoxy)acetyl]-cyclopropylamino]propanoic acid
CID 60845240
N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide
CID 102684250
2-[[2-(2-bromo-4-fluorophenoxy)acetyl]-cyclopropylamino]acetic acid
CID 60825836
N-[(3aS,6aR)-5-(dimethylamino)-1,2,3,3a,4,5,6,6a-octahydropentalen-2-yl]-2-(2,4-difluorophenoxy)-N-methylacetamide
CID 134706613
2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-cyclopropyl-N-ethylacetamide
CID 107700484
2-(2-bromo-4-fluorophenoxy)-N,N-bis(2-hydroxyethyl)acetamide
CID 60653739
N-cyclopropyl-N-(2-hydroxyethyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 43576640
2-[2-[cyclopropyl(methyl)amino]-2-oxoethoxy]-5-fluorobenzoic acid
CID 113281438
2-[2-(2-aminoethyl)-4-fluorophenoxy]-N-cyclopropyl-N-methylacetamide
CID 107699900

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide (CID 43577200) is N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide is O=C(COc1ccc(F)cc1F)N(CCO)C1CC1.
What is the InChIKey of N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide?
The InChIKey is FLJGSTVIPLOADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F2NO3/c14-9-1-4-12(11(15)7-9)19-8-13(18)16(5-6-17)10-2-3-10/h1,4,7,10,17H,2-3,5-6,8H2.
What are the key properties of N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide?
N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide has a molecular weight of 271.26 g/mol, XLogP of 1.33, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 43577200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).