5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide

C18H15FN2O2 — CID 51185180

IUPAC5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide
SMILESCC(NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccncc1
InChIInChI=1S/C18H15FN2O2/c1-12(13-8-10-20-11-9-13)21-18(22)17-7-6-16(23-17)14-2-4-15(19)5-3-14/h2-12H,1H3,(H,21,22)
InChIKeyYTMFLXLNDOQNJB-UHFFFAOYSA-N
MW310.33 g/mol
LogP3.97
Rot. Bonds4

About 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide

5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide (PubChem CID 51185180) has the molecular formula C18H15FN2O2 and a molecular weight of 310.33 g/mol. Its IUPAC name is 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide
PubChem CID51185180
Molecular FormulaC18H15FN2O2
Molecular Weight310.33 g/mol
Exact Mass310.11
IUPAC Name5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide
SMILESCC(NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccncc1
InChIInChI=1S/C18H15FN2O2/c1-12(13-8-10-20-11-9-13)21-18(22)17-7-6-16(23-17)14-2-4-15(19)5-3-14/h2-12H,1H3,(H,21,22)
InChIKeyYTMFLXLNDOQNJB-UHFFFAOYSA-N
XLogP3.97
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(4-chlorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide
CID 24639226
5-(4-fluorophenyl)-N-propan-2-ylfuran-2-carboxamide
CID 4290851
(2S)-2-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]-3-methylbutanoic acid
CID 94317037
N-[(1S)-1-(4-fluorophenyl)ethyl]-5-methylfuran-2-carboxamide
CID 2452836
N-[1-(4-fluorophenyl)ethyl]-5-methylfuran-2-carboxamide
CID 4878419
methyl 2-[[5-(4-fluorophenyl)furan-2-carbonyl]amino]-4-methylpentanoate
CID 3646174
N-[(1S)-2-amino-2-oxo-1-phenylethyl]-5-(4-fluorophenyl)furan-2-carboxamide
CID 51475340
2,4-difluoro-N-(1-pyridin-4-ylethyl)benzamide
CID 43006008
5-(2-fluorophenyl)-N-[(1R)-1-phenylethyl]furan-2-carboxamide
CID 51427238
N-(3-amino-2-methylpropyl)-5-(4-fluorophenyl)furan-2-carboxamide
CID 119995910
5-[3-cyclohexyl-5-(4-fluorophenyl)imidazol-4-yl]-N-[(1R)-1-phenylethyl]furan-2-carboxamide
CID 95087066
5-[(2-oxo-1-pyridinyl)methyl]-N-(1-pyridin-4-ylethyl)furan-2-carboxamide
CID 134024480

Frequently Asked Questions

What is the IUPAC name of 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide?
The IUPAC name of 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide (CID 51185180) is 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide.
What is the SMILES notation for 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide?
The canonical SMILES for 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide is CC(NC(=O)c1ccc(-c2ccc(F)cc2)o1)c1ccncc1.
What is the InChIKey of 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide?
The InChIKey is YTMFLXLNDOQNJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O2/c1-12(13-8-10-20-11-9-13)21-18(22)17-7-6-16(23-17)14-2-4-15(19)5-3-14/h2-12H,1H3,(H,21,22).
What are the key properties of 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide?
5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide has a molecular weight of 310.33 g/mol, XLogP of 3.97, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-fluorophenyl)-N-(1-pyridin-4-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 51185180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).