N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide

C17H18FNO2 — CID 60654052

IUPACN-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1ccccc1F)N(CCO)Cc1ccccc1
InChIInChI=1S/C17H18FNO2/c18-16-9-5-4-8-15(16)12-17(21)19(10-11-20)13-14-6-2-1-3-7-14/h1-9,20H,10-13H2
InChIKeyNDKIXZKCFKYORI-UHFFFAOYSA-N
MW287.33 g/mol
LogP2.39
Rot. Bonds6

About N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide

N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide (PubChem CID 60654052) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
PubChem CID60654052
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC NameN-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide
SMILESO=C(Cc1ccccc1F)N(CCO)Cc1ccccc1
InChIInChI=1S/C17H18FNO2/c18-16-9-5-4-8-15(16)12-17(21)19(10-11-20)13-14-6-2-1-3-7-14/h1-9,20H,10-13H2
InChIKeyNDKIXZKCFKYORI-UHFFFAOYSA-N
XLogP2.39
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 52.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-aminoethyl)-2-(2-fluorophenyl)-N-(2-phenylethyl)acetamide
CID 120885714
N-benzyl-N-(2-hydroxyethyl)-2-pyridin-3-ylacetamide
CID 62689181
N-benzyl-N-(2-hydroxyethyl)-2-thiophen-3-ylacetamide
CID 60653994
N-benzyl-N-[2-(dimethylamino)ethyl]-3-(2-fluorophenyl)propanamide
CID 78811483
N'-benzyl-N,N,N'-tris(2-hydroxyethyl)oxamide
CID 108509868
N-benzyl-5-hydroxy-N-(2-hydroxyethyl)pentanamide
CID 79191990
N-benzyl-N-(2-hydroxyethyl)-2-(methylamino)acetamide
CID 58786294
6-[benzyl(2-hydroxyethyl)amino]-6-oxohexanoic acid
CID 60948107
N-benzyl-2,2-difluoro-N-(2-hydroxyethyl)acetamide
CID 103513904
N-(2-hydroxyethyl)-2-(2-methoxyphenyl)-N-[(4-methylsulfanylphenyl)methyl]acetamide
CID 46983806
N-benzyl-N-(2-hydroxyethyl)-3-phenylbutanamide
CID 110878165
N-benzyl-N-(2-hydroxyethyl)-3-methylpentanamide
CID 114875389

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide (CID 60654052) is N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide is O=C(Cc1ccccc1F)N(CCO)Cc1ccccc1.
What is the InChIKey of N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
The InChIKey is NDKIXZKCFKYORI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c18-16-9-5-4-8-15(16)12-17(21)19(10-11-20)13-14-6-2-1-3-7-14/h1-9,20H,10-13H2.
What are the key properties of N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide?
N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide has a molecular weight of 287.33 g/mol, XLogP of 2.39, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(2-fluorophenyl)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 60654052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).