1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one

C16H11F2N5O2 — CID 47058481

IUPAC1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
SMILESO=c1ccc(-c2nnco2)cn1Cc1nc2ccccc2n1C(F)F
InChIInChI=1S/C16H11F2N5O2/c17-16(18)23-12-4-2-1-3-11(12)20-13(23)8-22-7-10(5-6-14(22)24)15-21-19-9-25-15/h1-7,9,16H,8H2
InChIKeyGJKUSTACPNZPRE-UHFFFAOYSA-N
MW343.29 g/mol
LogP2.69
Rot. Bonds4

About 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one

1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one (PubChem CID 47058481) has the molecular formula C16H11F2N5O2 and a molecular weight of 343.29 g/mol. Its IUPAC name is 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one.

Molecular Properties

Compound Name1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
PubChem CID47058481
Molecular FormulaC16H11F2N5O2
Molecular Weight343.29 g/mol
Exact Mass343.09
IUPAC Name1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
SMILESO=c1ccc(-c2nnco2)cn1Cc1nc2ccccc2n1C(F)F
InChIInChI=1S/C16H11F2N5O2/c17-16(18)23-12-4-2-1-3-11(12)20-13(23)8-22-7-10(5-6-14(22)24)15-21-19-9-25-15/h1-7,9,16H,8H2
InChIKeyGJKUSTACPNZPRE-UHFFFAOYSA-N
XLogP2.69
TPSA78.74 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500343.29
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one with MolForge

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Related Compounds

1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
CID 47045849
1-[2-(2-fluorophenoxy)ethyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
CID 47045848
1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-3-(trifluoromethyl)pyridin-2-one
CID 39041789
5-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]thieno[3,2-c]pyridin-4-one
CID 122159077
1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
CID 53498269
1-(difluoromethyl)-2-[(4-methylpiperidin-1-yl)methyl]benzimidazole
CID 134000947
2-[[1-(difluoromethyl)benzimidazol-2-yl]methylsulfanyl]-5-phenyl-1,3,4-oxadiazole
CID 16625010
(3S)-1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]piperidin-3-ol
CID 94033633
3-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(4-fluorophenyl)-5-methylimidazolidine-2,4-dione
CID 42952401
[1-(difluoromethyl)benzimidazol-2-yl]methyl (2S)-2-(furan-2-carbonylamino)propanoate
CID 32739273
[1-(difluoromethyl)benzimidazol-2-yl]methyl 1-methylpyrazole-4-carboxylate
CID 16625572
1-(difluoromethyl)-2-phenylbenzimidazole
CID 91167618

Frequently Asked Questions

What is the IUPAC name of 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
The IUPAC name of 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one (CID 47058481) is 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one.
What is the SMILES notation for 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
The canonical SMILES for 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one is O=c1ccc(-c2nnco2)cn1Cc1nc2ccccc2n1C(F)F.
What is the InChIKey of 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
The InChIKey is GJKUSTACPNZPRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2N5O2/c17-16(18)23-12-4-2-1-3-11(12)20-13(23)8-22-7-10(5-6-14(22)24)15-21-19-9-25-15/h1-7,9,16H,8H2.
What are the key properties of 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one has a molecular weight of 343.29 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one is sourced from PubChem (CID 47058481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).