2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide

C20H14FN3O3 — CID 142440284

IUPAC2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide
SMILESCc1cc(NC(=O)c2ccccc2F)cc(-c2nnc(-c3ccco3)o2)c1
InChIInChI=1S/C20H14FN3O3/c1-12-9-13(19-23-24-20(27-19)17-7-4-8-26-17)11-14(10-12)22-18(25)15-5-2-3-6-16(15)21/h2-11H,1H3,(H,22,25)
InChIKeyIAWNPQZSGJZYRO-UHFFFAOYSA-N
MW363.35 g/mol
LogP4.70
Rot. Bonds4

About 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide

2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide (PubChem CID 142440284) has the molecular formula C20H14FN3O3 and a molecular weight of 363.35 g/mol. Its IUPAC name is 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide
PubChem CID142440284
Molecular FormulaC20H14FN3O3
Molecular Weight363.35 g/mol
Exact Mass363.10
IUPAC Name2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide
SMILESCc1cc(NC(=O)c2ccccc2F)cc(-c2nnc(-c3ccco3)o2)c1
InChIInChI=1S/C20H14FN3O3/c1-12-9-13(19-23-24-20(27-19)17-7-4-8-26-17)11-14(10-12)22-18(25)15-5-2-3-6-16(15)21/h2-11H,1H3,(H,22,25)
InChIKeyIAWNPQZSGJZYRO-UHFFFAOYSA-N
XLogP4.70
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.35
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-cyano-5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-fluorobenzamide
CID 142440189
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
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-(trifluoromethyl)benzamide
CID 142440079
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]pyridine-3-carboxamide
CID 142440215
ethane;N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-methoxy-5-methylbenzamide
CID 142440037
5-chloro-N-[5-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-3-pyridinyl]-2-methylbenzamide
CID 148562905
N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-2-prop-1-ynylbenzamide
CID 146493966
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]-6-methoxybenzamide
CID 142440100
3-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]phenyl]pyridine-2-carboxamide
CID 142440398

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide?
The IUPAC name of 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide (CID 142440284) is 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide?
The canonical SMILES for 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide is Cc1cc(NC(=O)c2ccccc2F)cc(-c2nnc(-c3ccco3)o2)c1.
What is the InChIKey of 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide?
The InChIKey is IAWNPQZSGJZYRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14FN3O3/c1-12-9-13(19-23-24-20(27-19)17-7-4-8-26-17)11-14(10-12)22-18(25)15-5-2-3-6-16(15)21/h2-11H,1H3,(H,22,25).
What are the key properties of 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide?
2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide has a molecular weight of 363.35 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[3-[5-(furan-2-yl)-1,3,4-oxadiazol-2-yl]-5-methylphenyl]benzamide is sourced from PubChem (CID 142440284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).