3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide

C17H20FNO3 — CID 18161141

IUPAC3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide
SMILESCOCC(C)NC(=O)CCc1ccc(-c2ccccc2F)o1
InChIInChI=1S/C17H20FNO3/c1-12(11-21-2)19-17(20)10-8-13-7-9-16(22-13)14-5-3-4-6-15(14)18/h3-7,9,12H,8,10-11H2,1-2H3,(H,19,20)
InChIKeyQFXMLSGOOPPBKB-UHFFFAOYSA-N
MW305.35 g/mol
LogP3.17
Rot. Bonds7

About 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide

3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide (PubChem CID 18161141) has the molecular formula C17H20FNO3 and a molecular weight of 305.35 g/mol. Its IUPAC name is 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide.

Molecular Properties

Compound Name3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide
PubChem CID18161141
Molecular FormulaC17H20FNO3
Molecular Weight305.35 g/mol
Exact Mass305.14
IUPAC Name3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide
SMILESCOCC(C)NC(=O)CCc1ccc(-c2ccccc2F)o1
InChIInChI=1S/C17H20FNO3/c1-12(11-21-2)19-17(20)10-8-13-7-9-16(22-13)14-5-3-4-6-15(14)18/h3-7,9,12H,8,10-11H2,1-2H3,(H,19,20)
InChIKeyQFXMLSGOOPPBKB-UHFFFAOYSA-N
XLogP3.17
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.35
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide?
The IUPAC name of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide (CID 18161141) is 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide.
What is the SMILES notation for 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide?
The canonical SMILES for 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide is COCC(C)NC(=O)CCc1ccc(-c2ccccc2F)o1.
What is the InChIKey of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide?
The InChIKey is QFXMLSGOOPPBKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20FNO3/c1-12(11-21-2)19-17(20)10-8-13-7-9-16(22-13)14-5-3-4-6-15(14)18/h3-7,9,12H,8,10-11H2,1-2H3,(H,19,20).
What are the key properties of 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide?
3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide has a molecular weight of 305.35 g/mol, XLogP of 3.17, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[5-(2-fluorophenyl)furan-2-yl]-N-(1-methoxypropan-2-yl)propanamide is sourced from PubChem (CID 18161141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).