N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide

C15H14FNO2 — CID 36895021

IUPACN-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide
SMILESO=C(NCc1ccc(-c2ccc(F)cc2)o1)C1CC1
InChIInChI=1S/C15H14FNO2/c16-12-5-3-10(4-6-12)14-8-7-13(19-14)9-17-15(18)11-1-2-11/h3-8,11H,1-2,9H2,(H,17,18)
InChIKeyWBQYMONBURFXJT-UHFFFAOYSA-N
MW259.28 g/mol
LogP3.11
Rot. Bonds4

About N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide

N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide (PubChem CID 36895021) has the molecular formula C15H14FNO2 and a molecular weight of 259.28 g/mol. Its IUPAC name is N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide
PubChem CID36895021
Molecular FormulaC15H14FNO2
Molecular Weight259.28 g/mol
Exact Mass259.10
IUPAC NameN-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide
SMILESO=C(NCc1ccc(-c2ccc(F)cc2)o1)C1CC1
InChIInChI=1S/C15H14FNO2/c16-12-5-3-10(4-6-12)14-8-7-13(19-14)9-17-15(18)11-1-2-11/h3-8,11H,1-2,9H2,(H,17,18)
InChIKeyWBQYMONBURFXJT-UHFFFAOYSA-N
XLogP3.11
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-1-pyridin-3-ylsulfonylpiperidine-4-carboxamide
CID 43066570
(2R)-1-acetyl-N-[[5-(4-fluorophenyl)furan-2-yl]methyl]pyrrolidine-2-carboxamide
CID 125447070
(1R)-N-[[5-(4-chlorophenyl)furan-2-yl]methyl]cyclohex-3-ene-1-carboxamide
CID 40972536
N-[[5-(4-chlorophenyl)furan-2-yl]methyl]-4-fluorobenzamide
CID 54858020
2-[3-(dimethylamino)pyrrolidin-1-yl]-N-[[5-(4-fluorophenyl)furan-2-yl]methyl]acetamide
CID 91767930
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-2-[(2R)-morpholin-2-yl]acetamide
CID 125163130
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-2-morpholin-2-ylacetamide
CID 118763783
2,2,2-trifluoroethyl 4-[[5-(4-chlorophenyl)furan-2-yl]methylcarbamoyl]piperidine-1-carboxylate
CID 46532323
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-2-(3-methyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 131899563
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]-1,4,5,6-tetrahydrocyclopenta[d]pyrazole-3-carboxamide
CID 77085716
N-[[5-(4-bromophenyl)furan-2-yl]methyl]oxolane-2-carboxamide
CID 24646075
N-[[5-(4-bromophenyl)furan-2-yl]methyl]-2-methylcyclopropane-1-carboxamide
CID 24588410

Frequently Asked Questions

What is the IUPAC name of N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide?
The IUPAC name of N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide (CID 36895021) is N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide?
The canonical SMILES for N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide is O=C(NCc1ccc(-c2ccc(F)cc2)o1)C1CC1.
What is the InChIKey of N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide?
The InChIKey is WBQYMONBURFXJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FNO2/c16-12-5-3-10(4-6-12)14-8-7-13(19-14)9-17-15(18)11-1-2-11/h3-8,11H,1-2,9H2,(H,17,18).
What are the key properties of N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide?
N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide has a molecular weight of 259.28 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(4-fluorophenyl)furan-2-yl]methyl]cyclopropanecarboxamide is sourced from PubChem (CID 36895021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).