2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide

C20H23FN2O2 — CID 78899950

IUPAC2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide
SMILESO=C(CN(Cc1ccccc1)CC1CCCO1)Nc1ccccc1F
InChIInChI=1S/C20H23FN2O2/c21-18-10-4-5-11-19(18)22-20(24)15-23(14-17-9-6-12-25-17)13-16-7-2-1-3-8-16/h1-5,7-8,10-11,17H,6,9,12-15H2,(H,22,24)
InChIKeySGQFXKUXBFWXJL-UHFFFAOYSA-N
MW342.41 g/mol
LogP3.45
Rot. Bonds7

About 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide

2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide (PubChem CID 78899950) has the molecular formula C20H23FN2O2 and a molecular weight of 342.41 g/mol. Its IUPAC name is 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide
PubChem CID78899950
Molecular FormulaC20H23FN2O2
Molecular Weight342.41 g/mol
Exact Mass342.17
IUPAC Name2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide
SMILESO=C(CN(Cc1ccccc1)CC1CCCO1)Nc1ccccc1F
InChIInChI=1S/C20H23FN2O2/c21-18-10-4-5-11-19(18)22-20(24)15-23(14-17-9-6-12-25-17)13-16-7-2-1-3-8-16/h1-5,7-8,10-11,17H,6,9,12-15H2,(H,22,24)
InChIKeySGQFXKUXBFWXJL-UHFFFAOYSA-N
XLogP3.45
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.41
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluorophenyl)-2-[furan-2-ylmethyl(oxolan-2-ylmethyl)amino]acetamide
CID 86842664
2-[benzyl(oxolan-2-ylmethyl)amino]-N-phenylacetamide
CID 60514317
1-benzyl-3-(2-fluorophenyl)-1-(oxolan-2-ylmethyl)urea
CID 47070305
2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-methoxy-5-methylphenyl)acetamide
CID 55995832
2-[benzyl(oxolan-2-ylmethyl)amino]-N-(3-ethylphenyl)acetamide
CID 55840577
2-[bis(oxolan-2-ylmethyl)amino]-N-(2-bromophenyl)acetamide
CID 47056113
N-(2-chloro-4-fluorophenyl)-2-[(3-fluorophenyl)methyl-(oxolan-2-ylmethyl)amino]acetamide
CID 60606738
N-(2-fluoro-5-methylphenyl)-2-[(2-methylphenyl)methyl-[[(2S)-oxolan-2-yl]methyl]amino]acetamide
CID 124755387
N-benzyl-2-[(2-fluorophenyl)carbamoyl-(oxolan-2-ylmethyl)amino]-N-(furan-2-ylmethyl)acetamide
CID 5244605
3-[[2-[benzyl(oxolan-2-ylmethyl)amino]acetyl]amino]-N-cyclopropylbenzamide
CID 55994012
N-(5-chloro-2-fluorophenyl)-2-[[(2R)-oxolan-2-yl]methyl-(thiophen-2-ylmethyl)amino]acetamide
CID 9055561
N-(1-acetylpiperidin-4-yl)-2-[benzyl(oxolan-2-ylmethyl)amino]acetamide
CID 55995840

Frequently Asked Questions

What is the IUPAC name of 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide (CID 78899950) is 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide is O=C(CN(Cc1ccccc1)CC1CCCO1)Nc1ccccc1F.
What is the InChIKey of 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide?
The InChIKey is SGQFXKUXBFWXJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23FN2O2/c21-18-10-4-5-11-19(18)22-20(24)15-23(14-17-9-6-12-25-17)13-16-7-2-1-3-8-16/h1-5,7-8,10-11,17H,6,9,12-15H2,(H,22,24).
What are the key properties of 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide?
2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide has a molecular weight of 342.41 g/mol, XLogP of 3.45, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[benzyl(oxolan-2-ylmethyl)amino]-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 78899950), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).