1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine

C10H9NO2 — CID 556910

IUPAC1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine
SMILESC(=N/Cc1ccco1)\c1ccco1
InChIInChI=1S/C10H9NO2/c1-3-9(12-5-1)7-11-8-10-4-2-6-13-10/h1-7H,8H2/b11-7+
InChIKeyGRJDUZLBOIHZAV-YRNVUSSQSA-N
MW175.19 g/mol
LogP2.49
Rot. Bonds3

About 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine

1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine (PubChem CID 556910) has the molecular formula C10H9NO2 and a molecular weight of 175.19 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine
PubChem CID556910
Molecular FormulaC10H9NO2
Molecular Weight175.19 g/mol
Exact Mass175.06
IUPAC Name1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine
SMILESC(=N/Cc1ccco1)\c1ccco1
InChIInChI=1S/C10H9NO2/c1-3-9(12-5-1)7-11-8-10-4-2-6-13-10/h1-7H,8H2/b11-7+
InChIKeyGRJDUZLBOIHZAV-YRNVUSSQSA-N
XLogP2.49
TPSA38.64 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 52.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine?
The IUPAC name of 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine (CID 556910) is 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine.
What is the SMILES notation for 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine?
The canonical SMILES for 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine is C(=N/Cc1ccco1)\c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine?
The InChIKey is GRJDUZLBOIHZAV-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H9NO2/c1-3-9(12-5-1)7-11-8-10-4-2-6-13-10/h1-7H,8H2/b11-7+.
What are the key properties of 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine?
1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine has a molecular weight of 175.19 g/mol, XLogP of 2.49, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-(furan-2-ylmethyl)methanimine is sourced from PubChem (CID 556910), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).