N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide

C18H20FNO2 — CID 78781458

IUPACN-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide
SMILESCOCCN(Cc1ccccc1)C(=O)Cc1ccc(F)cc1
InChIInChI=1S/C18H20FNO2/c1-22-12-11-20(14-16-5-3-2-4-6-16)18(21)13-15-7-9-17(19)10-8-15/h2-10H,11-14H2,1H3
InChIKeyMTEATGCGUCJZQW-UHFFFAOYSA-N
MW301.36 g/mol
LogP3.04
Rot. Bonds7

About N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide

N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide (PubChem CID 78781458) has the molecular formula C18H20FNO2 and a molecular weight of 301.36 g/mol. Its IUPAC name is N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound NameN-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide
PubChem CID78781458
Molecular FormulaC18H20FNO2
Molecular Weight301.36 g/mol
Exact Mass301.15
IUPAC NameN-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide
SMILESCOCCN(Cc1ccccc1)C(=O)Cc1ccc(F)cc1
InChIInChI=1S/C18H20FNO2/c1-22-12-11-20(14-16-5-3-2-4-6-16)18(21)13-15-7-9-17(19)10-8-15/h2-10H,11-14H2,1H3
InChIKeyMTEATGCGUCJZQW-UHFFFAOYSA-N
XLogP3.04
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.36
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-[(4-fluorophenyl)methyl-(thiophen-2-ylmethyl)amino]-2-oxoethyl]-N-(2-methoxyethyl)-2-phenylacetamide
CID 5056995
N-[(4-fluorophenyl)methyl]-N-(2-methoxyethyl)acetamide
CID 22660909
N-benzyl-2-[4-(4-fluorobenzoyl)phenoxy]-N-(2-methoxyethyl)acetamide
CID 9289798
(Z)-4-[(4-fluorophenyl)methyl-(2-methoxyethyl)amino]-2-hydroxy-4-oxobut-2-enoic acid
CID 54689319
N-[2-[benzyl(furan-2-ylmethyl)amino]-2-oxoethyl]-2-(4-fluorophenyl)-N-(3-methoxypropyl)acetamide
CID 3675725
N-benzyl-4-hydroxy-N-(2-methoxyethyl)butanamide
CID 79205106
2-[benzyl(2-methoxyethyl)amino]-2-oxoacetic acid
CID 127020353
2-[benzylcarbamoyl(2-methoxyethyl)amino]-N-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]acetamide
CID 4205896
N-benzyl-2,2-difluoro-N-(2-methoxyethyl)acetamide
CID 103515233
N-benzyl-N-(2-methoxyethyl)-2-(2-methoxyethylamino)acetamide
CID 78914153
1-benzyl-3-(4-fluorophenyl)-1-(2-methoxyethyl)thiourea
CID 7967857
N-[(4-fluorophenyl)methyl]-N-[2-(1H-indol-3-yl)ethyl]-2-[(2-methoxyacetyl)-(2-methoxyethyl)amino]acetamide
CID 42772522

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide?
The IUPAC name of N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide (CID 78781458) is N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide?
The canonical SMILES for N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide is COCCN(Cc1ccccc1)C(=O)Cc1ccc(F)cc1.
What is the InChIKey of N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide?
The InChIKey is MTEATGCGUCJZQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO2/c1-22-12-11-20(14-16-5-3-2-4-6-16)18(21)13-15-7-9-17(19)10-8-15/h2-10H,11-14H2,1H3.
What are the key properties of N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide?
N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide has a molecular weight of 301.36 g/mol, XLogP of 3.04, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(4-fluorophenyl)-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 78781458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).