formamide;furan

C5H7NO2 — CID 53400763

IUPACformamide;furan
SMILESNC=O.c1ccoc1
InChIInChI=1S/C4H4O.CH3NO/c1-2-4-5-3-1;2-1-3/h1-4H;1H,(H2,2,3)
InChIKeyQUIPXVWMLNVFSF-UHFFFAOYSA-N
MW113.12 g/mol
LogP0.38
Rot. Bonds

About formamide;furan

formamide;furan (PubChem CID 53400763) has the molecular formula C5H7NO2 and a molecular weight of 113.12 g/mol. Its IUPAC name is formamide;furan.

Molecular Properties

Compound Nameformamide;furan
PubChem CID53400763
Molecular FormulaC5H7NO2
Molecular Weight113.12 g/mol
Exact Mass113.05
IUPAC Nameformamide;furan
SMILESNC=O.c1ccoc1
InChIInChI=1S/C4H4O.CH3NO/c1-2-4-5-3-1;2-1-3/h1-4H;1H,(H2,2,3)
InChIKeyQUIPXVWMLNVFSF-UHFFFAOYSA-N
XLogP0.38
TPSA56.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 50.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of formamide;furan?
The IUPAC name of formamide;furan (CID 53400763) is formamide;furan.
What is the SMILES notation for formamide;furan?
The canonical SMILES for formamide;furan is NC=O.c1ccoc1.
What is the InChIKey of formamide;furan?
The InChIKey is QUIPXVWMLNVFSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H4O.CH3NO/c1-2-4-5-3-1;2-1-3/h1-4H;1H,(H2,2,3).
What are the key properties of formamide;furan?
formamide;furan has a molecular weight of 113.12 g/mol, XLogP of 0.38, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for formamide;furan is sourced from PubChem (CID 53400763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).