N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide

C10H9NO5 — CID 90081191

IUPACN-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide
SMILESCC(=O)Nc1oc(-c2ccco2)c(O)c1O
InChIInChI=1S/C10H9NO5/c1-5(12)11-10-8(14)7(13)9(16-10)6-3-2-4-15-6/h2-4,13-14H,1H3,(H,11,12)
InChIKeyATQBWBPGGVUCJU-UHFFFAOYSA-N
MW223.18 g/mol
LogP1.91
Rot. Bonds2

About N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide

N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide (PubChem CID 90081191) has the molecular formula C10H9NO5 and a molecular weight of 223.18 g/mol. Its IUPAC name is N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide.

Molecular Properties

Compound NameN-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide
PubChem CID90081191
Molecular FormulaC10H9NO5
Molecular Weight223.18 g/mol
Exact Mass223.05
IUPAC NameN-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide
SMILESCC(=O)Nc1oc(-c2ccco2)c(O)c1O
InChIInChI=1S/C10H9NO5/c1-5(12)11-10-8(14)7(13)9(16-10)6-3-2-4-15-6/h2-4,13-14H,1H3,(H,11,12)
InChIKeyATQBWBPGGVUCJU-UHFFFAOYSA-N
XLogP1.91
TPSA95.84 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.18
LogP ≤ 51.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide?
The IUPAC name of N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide (CID 90081191) is N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide.
What is the SMILES notation for N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide?
The canonical SMILES for N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide is CC(=O)Nc1oc(-c2ccco2)c(O)c1O.
What is the InChIKey of N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide?
The InChIKey is ATQBWBPGGVUCJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9NO5/c1-5(12)11-10-8(14)7(13)9(16-10)6-3-2-4-15-6/h2-4,13-14H,1H3,(H,11,12).
What are the key properties of N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide?
N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide has a molecular weight of 223.18 g/mol, XLogP of 1.91, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(furan-2-yl)-3,4-dihydroxyfuran-2-yl]acetamide is sourced from PubChem (CID 90081191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).