N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide

C23H18FNO3 — CID 19412826

IUPACN-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1ccc(COc2cccc3ccccc23)o1
InChIInChI=1S/C23H18FNO3/c24-18-10-8-16(9-11-18)14-25-23(26)22-13-12-19(28-22)15-27-21-7-3-5-17-4-1-2-6-20(17)21/h1-13H,14-15H2,(H,25,26)
InChIKeyLXADCYCKIHFIJC-UHFFFAOYSA-N
MW375.40 g/mol
LogP5.08
Rot. Bonds6

About N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide

N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide (PubChem CID 19412826) has the molecular formula C23H18FNO3 and a molecular weight of 375.40 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
PubChem CID19412826
Molecular FormulaC23H18FNO3
Molecular Weight375.40 g/mol
Exact Mass375.13
IUPAC NameN-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
SMILESO=C(NCc1ccc(F)cc1)c1ccc(COc2cccc3ccccc23)o1
InChIInChI=1S/C23H18FNO3/c24-18-10-8-16(9-11-18)14-25-23(26)22-13-12-19(28-22)15-27-21-7-3-5-17-4-1-2-6-20(17)21/h1-13H,14-15H2,(H,25,26)
InChIKeyLXADCYCKIHFIJC-UHFFFAOYSA-N
XLogP5.08
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.40
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(4-fluorophenyl)methyl]-5-(phenoxymethyl)furan-2-carboxamide
CID 7975174
5-(naphthalen-1-yloxymethyl)-N-(pyridin-3-ylmethyl)furan-2-carboxamide
CID 2166258
N-(2-methylpropyl)-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
CID 19412877
5-(naphthalen-1-yloxymethyl)-N-(2-phenylethyl)furan-2-carboxamide
CID 35526034
5-(naphthalen-1-yloxymethyl)furan-2-carboxylate
CID 3596350
N-[1-[(4-fluorophenyl)methyl]pyrazol-3-yl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
CID 19285000
5-(naphthalen-1-yloxymethyl)-N-(4-phenylphenyl)furan-2-carboxamide
CID 19412894
5-[(4-fluorophenoxy)methyl]-N-[[4-(pyridin-2-ylmethoxy)phenyl]methyl]furan-2-carboxamide
CID 55902012
N-[(4-chloro-1-ethylpyrazol-3-yl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide
CID 19331232
5-[(4-fluorophenoxy)methyl]-N-[(2-methylphenyl)methyl]furan-2-carboxamide
CID 39731102
5-[(4-fluorophenoxy)methyl]-N-[(6-methyl-2-pyridinyl)methyl]furan-2-carboxamide
CID 87041338
N-[(4-fluorophenyl)methyl]-5-[(4-methyl-2-nitrophenoxy)methyl]furan-2-carboxamide
CID 19461206

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide (CID 19412826) is N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide is O=C(NCc1ccc(F)cc1)c1ccc(COc2cccc3ccccc23)o1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
The InChIKey is LXADCYCKIHFIJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18FNO3/c24-18-10-8-16(9-11-18)14-25-23(26)22-13-12-19(28-22)15-27-21-7-3-5-17-4-1-2-6-20(17)21/h1-13H,14-15H2,(H,25,26).
What are the key properties of N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide?
N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide has a molecular weight of 375.40 g/mol, XLogP of 5.08, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-5-(naphthalen-1-yloxymethyl)furan-2-carboxamide is sourced from PubChem (CID 19412826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).