2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide

C11H14F2N2O2 — CID 82817938

IUPAC2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide
SMILESCc1ccc(F)c(NC(=O)COCCN)c1F
InChIInChI=1S/C11H14F2N2O2/c1-7-2-3-8(12)11(10(7)13)15-9(16)6-17-5-4-14/h2-3H,4-6,14H2,1H3,(H,15,16)
InChIKeyPCIFBAVGXBGMAB-UHFFFAOYSA-N
MW244.24 g/mol
LogP1.19
Rot. Bonds5

About 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide

2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide (PubChem CID 82817938) has the molecular formula C11H14F2N2O2 and a molecular weight of 244.24 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide
PubChem CID82817938
Molecular FormulaC11H14F2N2O2
Molecular Weight244.24 g/mol
Exact Mass244.10
IUPAC Name2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide
SMILESCc1ccc(F)c(NC(=O)COCCN)c1F
InChIInChI=1S/C11H14F2N2O2/c1-7-2-3-8(12)11(10(7)13)15-9(16)6-17-5-4-14/h2-3H,4-6,14H2,1H3,(H,15,16)
InChIKeyPCIFBAVGXBGMAB-UHFFFAOYSA-N
XLogP1.19
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.24
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-(2,6-difluoro-3-methylphenyl)propanamide
CID 82820072
2-(2-aminoethoxy)-N-(2-fluoro-5-methylphenyl)acetamide
CID 79464256
3-(2,6-difluoro-3-methylanilino)-3-oxopropanoic acid
CID 82820377
2-(2-aminoethoxy)-N-(2-fluoro-4-methylphenyl)acetamide
CID 79463499
2-(2-aminoethoxy)-N-(3,4,5-trifluorophenyl)acetamide
CID 79478578
4-amino-N-(2,6-difluoro-3-methylphenyl)-4-methylpentanamide
CID 82819149
N-(2,6-difluoro-3-methylphenyl)-4-hydroxybutanamide
CID 82819991
2-(2-aminoethoxy)-1-(2,3-difluoro-4-methylphenyl)ethanone
CID 107514948
N-(4-acetamidophenyl)-2-(2-aminoethoxy)acetamide
CID 79463401
ethyl N-[4-[[2-(2-aminoethoxy)acetyl]amino]phenyl]carbamate
CID 79472872
N-(2,6-difluoro-3-methylphenyl)-2-(prop-2-ynylamino)acetamide
CID 82817941
2-ethoxy-N-(2-fluoro-6-methylphenyl)acetamide
CID 115909342

Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide (CID 82817938) is 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide is Cc1ccc(F)c(NC(=O)COCCN)c1F.
What is the InChIKey of 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide?
The InChIKey is PCIFBAVGXBGMAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14F2N2O2/c1-7-2-3-8(12)11(10(7)13)15-9(16)6-17-5-4-14/h2-3H,4-6,14H2,1H3,(H,15,16).
What are the key properties of 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide?
2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide has a molecular weight of 244.24 g/mol, XLogP of 1.19, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(2,6-difluoro-3-methylphenyl)acetamide is sourced from PubChem (CID 82817938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).