2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide

C15H15FN2O3 — CID 113161076

IUPAC2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(F)cc1)Cc1ccco1
InChIInChI=1S/C15H15FN2O3/c1-11(19)18(9-14-3-2-8-21-14)10-15(20)17-13-6-4-12(16)5-7-13/h2-8H,9-10H2,1H3,(H,17,20)
InChIKeyIKHPVBYEMVLYHC-UHFFFAOYSA-N
MW290.29 g/mol
LogP2.41
Rot. Bonds5

About 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide

2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide (PubChem CID 113161076) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide
PubChem CID113161076
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC Name2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccc(F)cc1)Cc1ccco1
InChIInChI=1S/C15H15FN2O3/c1-11(19)18(9-14-3-2-8-21-14)10-15(20)17-13-6-4-12(16)5-7-13/h2-8H,9-10H2,1H3,(H,17,20)
InChIKeyIKHPVBYEMVLYHC-UHFFFAOYSA-N
XLogP2.41
TPSA62.55 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[acetyl(furan-2-ylmethyl)amino]-N-[4-(trifluoromethyl)phenyl]acetamide
CID 113161103
2-[acetyl(furan-2-ylmethyl)amino]-N-(2,6-dichlorophenyl)acetamide
CID 113161143
2-[acetyl-[(2-methoxyphenyl)methyl]amino]-N-(4-fluorophenyl)acetamide
CID 113162953
3-[acetyl(furan-2-ylmethyl)amino]-N-[4-(diethylamino)phenyl]propanamide
CID 113118135
2-[[2-(4-acetamidophenyl)sulfanylacetyl]-(furan-2-ylmethyl)amino]-N-phenylacetamide
CID 24518090
2-[acetyl(furan-2-ylmethyl)amino]-N-(1-phenylethyl)acetamide
CID 113160988
2-[acetyl(furan-2-ylmethyl)amino]-N-cycloheptylacetamide
CID 113161038
3-[acetyl(furan-2-ylmethyl)amino]-N-(3,4-dimethylphenyl)propanamide
CID 113118081
2-[acetyl(propyl)amino]-N-[(4-fluorophenyl)methyl]-N-(furan-2-ylmethyl)acetamide
CID 42773488
2-[[(3S)-1,1-dioxothiolan-3-yl]-(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide
CID 25479249
N-[2-(2-bromoanilino)-2-oxoethyl]-4-fluoro-N-(furan-2-ylmethyl)benzamide
CID 4779798
N-(4-tert-butylphenyl)-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 31379581

Frequently Asked Questions

What is the IUPAC name of 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide?
The IUPAC name of 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide (CID 113161076) is 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide.
What is the SMILES notation for 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide?
The canonical SMILES for 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide is CC(=O)N(CC(=O)Nc1ccc(F)cc1)Cc1ccco1.
What is the InChIKey of 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide?
The InChIKey is IKHPVBYEMVLYHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c1-11(19)18(9-14-3-2-8-21-14)10-15(20)17-13-6-4-12(16)5-7-13/h2-8H,9-10H2,1H3,(H,17,20).
What are the key properties of 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide?
2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide has a molecular weight of 290.29 g/mol, XLogP of 2.41, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[acetyl(furan-2-ylmethyl)amino]-N-(4-fluorophenyl)acetamide is sourced from PubChem (CID 113161076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).