5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide

C19H15F2NO3 — CID 141116560

IUPAC5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(OC(F)F)cc2)cc1C(=O)Nc1ccccc1
InChIInChI=1S/C19H15F2NO3/c1-12-16(18(23)22-14-5-3-2-4-6-14)11-17(24-12)13-7-9-15(10-8-13)25-19(20)21/h2-11,19H,1H3,(H,22,23)
InChIKeyAYYGAJMWEIAQNR-UHFFFAOYSA-N
MW343.33 g/mol
LogP5.11
Rot. Bonds5

About 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide

5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide (PubChem CID 141116560) has the molecular formula C19H15F2NO3 and a molecular weight of 343.33 g/mol. Its IUPAC name is 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide.

Molecular Properties

Compound Name5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide
PubChem CID141116560
Molecular FormulaC19H15F2NO3
Molecular Weight343.33 g/mol
Exact Mass343.10
IUPAC Name5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide
SMILESCc1oc(-c2ccc(OC(F)F)cc2)cc1C(=O)Nc1ccccc1
InChIInChI=1S/C19H15F2NO3/c1-12-16(18(23)22-14-5-3-2-4-6-14)11-17(24-12)13-7-9-15(10-8-13)25-19(20)21/h2-11,19H,1H3,(H,22,23)
InChIKeyAYYGAJMWEIAQNR-UHFFFAOYSA-N
XLogP5.11
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.33
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-carbamoylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 17015561
2-methyl-N,5-bis(4-methylphenyl)furan-3-carboxamide
CID 16650715
[4-[2-[4-[[5-[4-(difluoromethoxy)phenyl]-2-methylfuran-3-carbonyl]amino]phenyl]acetyl]sulfinamoylphenyl] acetate
CID 143035366
N-(4-iodophenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 1340506
N-(4-acetylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 16650627
2-methyl-5-phenyl-N-(3-propoxyphenyl)furan-3-carboxamide
CID 2864448
5-(4-bromophenyl)-N-(4-ethoxyphenyl)-2-methylfuran-3-carboxamide
CID 16651497
N-(3-chlorophenyl)-5-(4-chlorophenyl)-2-methylfuran-3-carboxamide
CID 16651378
5-(4-chlorophenyl)-N-(3-fluorophenyl)-2-methylfuran-3-carboxamide
CID 16651382
butyl 4-[(2-methyl-5-phenylfuran-3-carbonyl)amino]benzoate
CID 16650686
N-(4-butylphenyl)-2-methyl-5-phenylfuran-3-carboxamide
CID 16650691
5-(3,4-dichlorophenyl)-N-(4-methoxyphenyl)-2-methylfuran-3-carboxamide
CID 2958681

Frequently Asked Questions

What is the IUPAC name of 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide?
The IUPAC name of 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide (CID 141116560) is 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide.
What is the SMILES notation for 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide?
The canonical SMILES for 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide is Cc1oc(-c2ccc(OC(F)F)cc2)cc1C(=O)Nc1ccccc1.
What is the InChIKey of 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide?
The InChIKey is AYYGAJMWEIAQNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2NO3/c1-12-16(18(23)22-14-5-3-2-4-6-14)11-17(24-12)13-7-9-15(10-8-13)25-19(20)21/h2-11,19H,1H3,(H,22,23).
What are the key properties of 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide?
5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide has a molecular weight of 343.33 g/mol, XLogP of 5.11, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(difluoromethoxy)phenyl]-2-methyl-N-phenylfuran-3-carboxamide is sourced from PubChem (CID 141116560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).