5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide

C22H24FNO3 — CID 43066719

IUPAC5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide
SMILESO=C(NC1CC2CC1C1CCCC21)c1ccc(COc2ccc(F)cc2)o1
InChIInChI=1S/C22H24FNO3/c23-14-4-6-15(7-5-14)26-12-16-8-9-21(27-16)22(25)24-20-11-13-10-19(20)18-3-1-2-17(13)18/h4-9,13,17-20H,1-3,10-12H2,(H,24,25)
InChIKeyYXHOYGCBPGNJPZ-UHFFFAOYSA-N
MW369.44 g/mol
LogP4.55
Rot. Bonds5

About 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide

5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide (PubChem CID 43066719) has the molecular formula C22H24FNO3 and a molecular weight of 369.44 g/mol. Its IUPAC name is 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide
PubChem CID43066719
Molecular FormulaC22H24FNO3
Molecular Weight369.44 g/mol
Exact Mass369.17
IUPAC Name5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide
SMILESO=C(NC1CC2CC1C1CCCC21)c1ccc(COc2ccc(F)cc2)o1
InChIInChI=1S/C22H24FNO3/c23-14-4-6-15(7-5-14)26-12-16-8-9-21(27-16)22(25)24-20-11-13-10-19(20)18-3-1-2-17(13)18/h4-9,13,17-20H,1-3,10-12H2,(H,24,25)
InChIKeyYXHOYGCBPGNJPZ-UHFFFAOYSA-N
XLogP4.55
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.44
LogP ≤ 54.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,3-dimethylcyclohexyl)-5-(phenoxymethyl)furan-2-carboxamide
CID 24819810
N-[(1S,2R,3R)-2,3-dimethylcyclohexyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 25352780
N-[1-(2,2-dimethylpropanoyl)piperidin-4-yl]-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide
CID 46476770
N-[(1R)-1-[(1S,2R,4S)-2-bicyclo[2.2.1]heptanyl]ethyl]-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide
CID 98421287
N-[1-(2-bicyclo[2.2.1]heptanyl)ethyl]-5-[(4-fluorophenoxy)methyl]furan-2-carboxamide
CID 19580094
N-[(1S,2S)-2-methylcyclohexyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 31462340
N-cyclohexyl-5-(phenoxymethyl)furan-2-carboxamide
CID 24980847
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-[(1R,2R,6S,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]acetamide
CID 124834964
N'-benzoyl-5-[(4-fluorophenoxy)methyl]furan-2-carbohydrazide
CID 27555711
5-[(4-acetylphenoxy)methyl]-N-cyclopentylfuran-2-carboxamide
CID 19455175
5-[(4-fluorophenoxy)methyl]-N-(4,5,6,7-tetrahydro-1H-indazol-5-yl)furan-2-carboxamide
CID 126787957
5-(methylsulfamoyl)-N-[(1R,2S,6S,7S,8R)-8-tricyclo[5.2.1.02,6]decanyl]furan-2-carboxamide
CID 124740416

Frequently Asked Questions

What is the IUPAC name of 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide?
The IUPAC name of 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide (CID 43066719) is 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide.
What is the SMILES notation for 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide?
The canonical SMILES for 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide is O=C(NC1CC2CC1C1CCCC21)c1ccc(COc2ccc(F)cc2)o1.
What is the InChIKey of 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide?
The InChIKey is YXHOYGCBPGNJPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24FNO3/c23-14-4-6-15(7-5-14)26-12-16-8-9-21(27-16)22(25)24-20-11-13-10-19(20)18-3-1-2-17(13)18/h4-9,13,17-20H,1-3,10-12H2,(H,24,25).
What are the key properties of 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide?
5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide has a molecular weight of 369.44 g/mol, XLogP of 4.55, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(4-fluorophenoxy)methyl]-N-(8-tricyclo[5.2.1.02,6]decanyl)furan-2-carboxamide is sourced from PubChem (CID 43066719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).