2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide

C14H11FN2O3 — CID 168522972

IUPAC2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide
SMILESN#CCC(=O)Nc1cc(F)ccc1OCc1ccco1
InChIInChI=1S/C14H11FN2O3/c15-10-3-4-13(20-9-11-2-1-7-19-11)12(8-10)17-14(18)5-6-16/h1-4,7-8H,5,9H2,(H,17,18)
InChIKeyYLONAQYPVVPFPY-UHFFFAOYSA-N
MW274.25 g/mol
LogP2.85
Rot. Bonds5

About 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide

2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide (PubChem CID 168522972) has the molecular formula C14H11FN2O3 and a molecular weight of 274.25 g/mol. Its IUPAC name is 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide.

Molecular Properties

Compound Name2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide
PubChem CID168522972
Molecular FormulaC14H11FN2O3
Molecular Weight274.25 g/mol
Exact Mass274.08
IUPAC Name2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide
SMILESN#CCC(=O)Nc1cc(F)ccc1OCc1ccco1
InChIInChI=1S/C14H11FN2O3/c15-10-3-4-13(20-9-11-2-1-7-19-11)12(8-10)17-14(18)5-6-16/h1-4,7-8H,5,9H2,(H,17,18)
InChIKeyYLONAQYPVVPFPY-UHFFFAOYSA-N
XLogP2.85
TPSA75.26 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.25
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-cyano-N-(2-cyclopentyloxy-5-fluorophenyl)acetamide
CID 168522226
N-[5-fluoro-2-[[(2S)-oxolan-2-yl]methoxy]phenyl]-3-(furan-2-yl)propanamide
CID 95341792
N-(2-bromo-5-fluorophenyl)-2-cyanoacetamide
CID 83317310
2-cyano-N-[2-(2,2,2-trifluoroethoxy)phenyl]acetamide
CID 168520948
N-(2,5-difluorophenyl)-2-(furan-2-ylmethylsulfanyl)acetamide
CID 112780738
[2-(2,5-difluoroanilino)-2-oxoethyl]-bis(furan-2-ylmethyl)azanium
CID 8841313
5-chloro-2-(furan-2-ylmethoxy)benzonitrile
CID 22661920
N-[3-fluoro-4-(furan-2-ylmethoxy)phenyl]formamide
CID 168652630
2-cyano-N-[2-(3-phenylpropoxy)phenyl]acetamide
CID 168520539
2-(2-acetyl-4-fluorophenoxy)-N-(furan-2-ylmethyl)acetamide
CID 112774601
2-[(2-cyanoacetyl)amino]-N-(4-fluorophenyl)benzamide
CID 168522524
N-[2-[(2-cyanoacetyl)amino]phenyl]-3-fluorobenzamide
CID 108922965

Frequently Asked Questions

What is the IUPAC name of 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide?
The IUPAC name of 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide (CID 168522972) is 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide.
What is the SMILES notation for 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide?
The canonical SMILES for 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide is N#CCC(=O)Nc1cc(F)ccc1OCc1ccco1.
What is the InChIKey of 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide?
The InChIKey is YLONAQYPVVPFPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11FN2O3/c15-10-3-4-13(20-9-11-2-1-7-19-11)12(8-10)17-14(18)5-6-16/h1-4,7-8H,5,9H2,(H,17,18).
What are the key properties of 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide?
2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide has a molecular weight of 274.25 g/mol, XLogP of 2.85, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyano-N-[5-fluoro-2-(furan-2-ylmethoxy)phenyl]acetamide is sourced from PubChem (CID 168522972), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).