1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine

C8H9NO — CID 13128411

IUPAC1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine
SMILESC/C=C/N=C/c1ccco1
InChIInChI=1S/C8H9NO/c1-2-5-9-7-8-4-3-6-10-8/h2-7H,1H3/b5-2+,9-7+
InChIKeyMNVOPFSKTYKJTN-MOSGBMRRSA-N
MW135.17 g/mol
LogP2.23
Rot. Bonds2

About 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine

1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine (PubChem CID 13128411) has the molecular formula C8H9NO and a molecular weight of 135.17 g/mol. Its IUPAC name is 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine.

Molecular Properties

Compound Name1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine
PubChem CID13128411
Molecular FormulaC8H9NO
Molecular Weight135.17 g/mol
Exact Mass135.07
IUPAC Name1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine
SMILESC/C=C/N=C/c1ccco1
InChIInChI=1S/C8H9NO/c1-2-5-9-7-8-4-3-6-10-8/h2-7H,1H3/b5-2+,9-7+
InChIKeyMNVOPFSKTYKJTN-MOSGBMRRSA-N
XLogP2.23
TPSA25.50 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(E)-1-(furan-2-yl)-N-trimethylsilylmethanimine
CID 10630921
1-(furan-2-yl)-N-oxidomethanimine
CID 135527449
1-(furan-2-yl)-N-[2-(furan-2-ylmethylideneamino)phenyl]methanimine
CID 10015655
ethane;1-(furan-2-yl)-N-phenylmethanimine
CID 160534475
N-[2,6-di(propan-2-yl)phenyl]-1-(furan-2-yl)methanimine
CID 850160
CID 171377962
CID 171377962
2-nona-1,3,5,7-tetraenylfuran
CID 173428871
1-(furan-2-yl)-N-hydroperoxymethanimine
CID 131862046
(E)-1-(furan-2-yl)-N-[(Z)-1-trimethylsilyloxyprop-1-enyl]methanimine
CID 135039350
(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
CID 46707076
(E)-N-bis(2,6-dimethylphenyl)phosphoryl-1-(furan-2-yl)methanimine
CID 44521537
(NE)-N-(furan-2-ylmethylidene)propane-2-sulfinamide
CID 177399008

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine?
The IUPAC name of 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine (CID 13128411) is 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine.
What is the SMILES notation for 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine?
The canonical SMILES for 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine is C/C=C/N=C/c1ccco1.
What is the InChIKey of 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine?
The InChIKey is MNVOPFSKTYKJTN-MOSGBMRRSA-N. The full InChI is InChI=1S/C8H9NO/c1-2-5-9-7-8-4-3-6-10-8/h2-7H,1H3/b5-2+,9-7+.
What are the key properties of 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine?
1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine has a molecular weight of 135.17 g/mol, XLogP of 2.23, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-yl)-N-[(E)-prop-1-enyl]methanimine is sourced from PubChem (CID 13128411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).