N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide

C20H11FN4O3 — CID 142440189

IUPACN-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide
SMILESN#Cc1cc(NC(=O)c2ccccc2F)cc(-c2nnc(-c3ccco3)o2)c1
InChIInChI=1S/C20H11FN4O3/c21-16-5-2-1-4-15(16)18(26)23-14-9-12(11-22)8-13(10-14)19-24-25-20(28-19)17-6-3-7-27-17/h1-10H,(H,23,26)
InChIKeyWUSQLZBMWMQCHN-UHFFFAOYSA-N
MW374.33 g/mol
LogP4.26
Rot. Bonds4

About N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide

N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide (PubChem CID 142440189) has the molecular formula C20H11FN4O3 and a molecular weight of 374.33 g/mol. Its IUPAC name is N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide
PubChem CID142440189
Molecular FormulaC20H11FN4O3
Molecular Weight374.33 g/mol
Exact Mass374.08
IUPAC NameN-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide
SMILESN#Cc1cc(NC(=O)c2ccccc2F)cc(-c2nnc(-c3ccco3)o2)c1
InChIInChI=1S/C20H11FN4O3/c21-16-5-2-1-4-15(16)18(26)23-14-9-12(11-22)8-13(10-14)19-24-25-20(28-19)17-6-3-7-27-17/h1-10H,(H,23,26)
InChIKeyWUSQLZBMWMQCHN-UHFFFAOYSA-N
XLogP4.26
TPSA104.95 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.33
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide
CID 142440284
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-4-methylphenyl]benzamide
CID 142440259
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-4-hydroxybenzamide
CID 142440315
N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-(trifluoromethyl)benzamide
CID 142440079
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]pyridine-3-carboxamide
CID 142440215
5-chloro-N-[3-chloro-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-methoxybenzamide
CID 146494644
methyl 2-[[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]carbamoyl]benzoate
CID 146494289
N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-prop-1-ynylbenzamide
CID 146493966
3-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]pyridine-2-carboxamide
CID 142440398
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-6-methoxybenzamide
CID 142440100
N-[4-(4-cyanoanilino)phenyl]-2-fluorobenzamide
CID 112990032
5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide
CID 148562905

Frequently Asked Questions

What is the IUPAC name of N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide?
The IUPAC name of N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide (CID 142440189) is N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide.
What is the SMILES notation for N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide?
The canonical SMILES for N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide is N#Cc1cc(NC(=O)c2ccccc2F)cc(-c2nnc(-c3ccco3)o2)c1.
What is the InChIKey of N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide?
The InChIKey is WUSQLZBMWMQCHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H11FN4O3/c21-16-5-2-1-4-15(16)18(26)23-14-9-12(11-22)8-13(10-14)19-24-25-20(28-19)17-6-3-7-27-17/h1-10H,(H,23,26).
What are the key properties of N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide?
N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide has a molecular weight of 374.33 g/mol, XLogP of 4.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide is sourced from PubChem (CID 142440189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).