4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide

C18H17F2N3O3 — CID 166309904

IUPAC4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide
SMILESCCN(Cc1occc1C)C(=O)c1ccc(-c2nnc(C(F)F)o2)cc1
InChIInChI=1S/C18H17F2N3O3/c1-3-23(10-14-11(2)8-9-25-14)18(24)13-6-4-12(5-7-13)16-21-22-17(26-16)15(19)20/h4-9,15H,3,10H2,1-2H3
InChIKeyYVBXGRPRPPBRCR-UHFFFAOYSA-N
MW361.35 g/mol
LogP4.24
Rot. Bonds6

About 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide

4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide (PubChem CID 166309904) has the molecular formula C18H17F2N3O3 and a molecular weight of 361.35 g/mol. Its IUPAC name is 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide.

Molecular Properties

Compound Name4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide
PubChem CID166309904
Molecular FormulaC18H17F2N3O3
Molecular Weight361.35 g/mol
Exact Mass361.12
IUPAC Name4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide
SMILESCCN(Cc1occc1C)C(=O)c1ccc(-c2nnc(C(F)F)o2)cc1
InChIInChI=1S/C18H17F2N3O3/c1-3-23(10-14-11(2)8-9-25-14)18(24)13-6-4-12(5-7-13)16-21-22-17(26-16)15(19)20/h4-9,15H,3,10H2,1-2H3
InChIKeyYVBXGRPRPPBRCR-UHFFFAOYSA-N
XLogP4.24
TPSA72.37 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.35
LogP ≤ 54.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]-N-(2-methylprop-2-enyl)benzamide
CID 134008813
2-chloro-N-ethyl-2-fluoro-N-[(3-methylfuran-2-yl)methyl]acetamide
CID 167984402
N,N-diethyl-4-(1,3,4-oxadiazol-2-yl)benzamide
CID 60656525
N,N-diethyl-4-[4-(5-methyl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]benzamide
CID 46397278
N,N-diethyl-5-(4-methylphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 110391105
4-[5-(3-methylfuran-2-yl)-1,3,4-oxadiazol-2-yl]benzoic acid
CID 63382464
1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl 3-methylfuran-2-carboxylate
CID 18283702
N-[[4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]phenyl]methyl]-N-(4-ethylphenyl)morpholine-4-carboxamide
CID 160590742
2-(difluoromethyl)-5-(3-fluoro-4-methylphenyl)-1,3,4-oxadiazole
CID 126507083
N-[2-(diethylamino)-2-oxoethyl]-4-[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 48503696
N-benzyl-N-ethyl-2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide
CID 42982138
[(1S)-1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl] 4-(diethylamino)benzoate
CID 9203278

Frequently Asked Questions

What is the IUPAC name of 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide?
The IUPAC name of 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide (CID 166309904) is 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide.
What is the SMILES notation for 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide?
The canonical SMILES for 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide is CCN(Cc1occc1C)C(=O)c1ccc(-c2nnc(C(F)F)o2)cc1.
What is the InChIKey of 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide?
The InChIKey is YVBXGRPRPPBRCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17F2N3O3/c1-3-23(10-14-11(2)8-9-25-14)18(24)13-6-4-12(5-7-13)16-21-22-17(26-16)15(19)20/h4-9,15H,3,10H2,1-2H3.
What are the key properties of 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide?
4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide has a molecular weight of 361.35 g/mol, XLogP of 4.24, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(difluoromethyl)-1,3,4-oxadiazol-2-yl]-N-ethyl-N-[(3-methylfuran-2-yl)methyl]benzamide is sourced from PubChem (CID 166309904), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).