N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide

C9H9N3O3 — CID 75357594

IUPACN-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide
SMILESCc1nnc(CNC(=O)c2ccco2)o1
InChIInChI=1S/C9H9N3O3/c1-6-11-12-8(15-6)5-10-9(13)7-3-2-4-14-7/h2-4H,5H2,1H3,(H,10,13)
InChIKeyQMOJPTFMKIXPDF-UHFFFAOYSA-N
MW207.19 g/mol
LogP0.90
Rot. Bonds3

About N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide

N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide (PubChem CID 75357594) has the molecular formula C9H9N3O3 and a molecular weight of 207.19 g/mol. Its IUPAC name is N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide
PubChem CID75357594
Molecular FormulaC9H9N3O3
Molecular Weight207.19 g/mol
Exact Mass207.06
IUPAC NameN-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide
SMILESCc1nnc(CNC(=O)c2ccco2)o1
InChIInChI=1S/C9H9N3O3/c1-6-11-12-8(15-6)5-10-9(13)7-3-2-4-14-7/h2-4H,5H2,1H3,(H,10,13)
InChIKeyQMOJPTFMKIXPDF-UHFFFAOYSA-N
XLogP0.90
TPSA81.16 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.19
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[5-(2-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl]furan-2-carboxamide
CID 110319665
N-[[5-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]furan-2-carboxamide
CID 4589681
N-[[5-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]furan-2-carboxamide
CID 5235710
3,4-dimethyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 110318313
(5-methyl-1,3,4-oxadiazol-2-yl)methylurea
CID 130738422
N-[[5-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-1,3,4-oxadiazol-2-yl]methyl]furan-2-carboxamide
CID 3245929
7-methyl-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-1-oxoisochromene-3-carboxamide
CID 172882424
2,3,4-trifluoro-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 110318351
N-[(5-methyl-1H-pyrazol-4-yl)methyl]furan-2-carboxamide
CID 60767686
2-chloro-6-fluoro-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]benzamide
CID 110318346
N-[[3-(hydroxymethyl)phenyl]methyl]furan-2-carboxamide
CID 55204470
N-[(1-ethyl-5-methylpyrazol-4-yl)methyl]furan-2-carboxamide
CID 19290411

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide?
The IUPAC name of N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide (CID 75357594) is N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide.
What is the SMILES notation for N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide?
The canonical SMILES for N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide is Cc1nnc(CNC(=O)c2ccco2)o1.
What is the InChIKey of N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide?
The InChIKey is QMOJPTFMKIXPDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3O3/c1-6-11-12-8(15-6)5-10-9(13)7-3-2-4-14-7/h2-4H,5H2,1H3,(H,10,13).
What are the key properties of N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide?
N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide has a molecular weight of 207.19 g/mol, XLogP of 0.90, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]furan-2-carboxamide is sourced from PubChem (CID 75357594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).