3-(furan-2-yl)furan-2-carboxamide

C9H7NO3 — CID 22065330

IUPAC3-(furan-2-yl)furan-2-carboxamide
SMILESNC(=O)c1occc1-c1ccco1
InChIInChI=1S/C9H7NO3/c10-9(11)8-6(3-5-13-8)7-2-1-4-12-7/h1-5H,(H2,10,11)
InChIKeyIVFXUCNONQKYMP-UHFFFAOYSA-N
MW177.16 g/mol
LogP1.64
Rot. Bonds2

About 3-(furan-2-yl)furan-2-carboxamide

3-(furan-2-yl)furan-2-carboxamide (PubChem CID 22065330) has the molecular formula C9H7NO3 and a molecular weight of 177.16 g/mol. Its IUPAC name is 3-(furan-2-yl)furan-2-carboxamide.

Molecular Properties

Compound Name3-(furan-2-yl)furan-2-carboxamide
PubChem CID22065330
Molecular FormulaC9H7NO3
Molecular Weight177.16 g/mol
Exact Mass177.04
IUPAC Name3-(furan-2-yl)furan-2-carboxamide
SMILESNC(=O)c1occc1-c1ccco1
InChIInChI=1S/C9H7NO3/c10-9(11)8-6(3-5-13-8)7-2-1-4-12-7/h1-5H,(H2,10,11)
InChIKeyIVFXUCNONQKYMP-UHFFFAOYSA-N
XLogP1.64
TPSA69.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.16
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-2-yl)furan-2-carboxamide?
The IUPAC name of 3-(furan-2-yl)furan-2-carboxamide (CID 22065330) is 3-(furan-2-yl)furan-2-carboxamide.
What is the SMILES notation for 3-(furan-2-yl)furan-2-carboxamide?
The canonical SMILES for 3-(furan-2-yl)furan-2-carboxamide is NC(=O)c1occc1-c1ccco1.
What is the InChIKey of 3-(furan-2-yl)furan-2-carboxamide?
The InChIKey is IVFXUCNONQKYMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7NO3/c10-9(11)8-6(3-5-13-8)7-2-1-4-12-7/h1-5H,(H2,10,11).
What are the key properties of 3-(furan-2-yl)furan-2-carboxamide?
3-(furan-2-yl)furan-2-carboxamide has a molecular weight of 177.16 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-2-yl)furan-2-carboxamide is sourced from PubChem (CID 22065330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).