N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine

C17H14N2O — CID 135513799

IUPACN-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine
SMILESC(=C(\N=C\c1ccc[nH]1)c1ccco1)\c1ccccc1
InChIInChI=1S/C17H14N2O/c1-2-6-14(7-3-1)12-16(17-9-5-11-20-17)19-13-15-8-4-10-18-15/h1-13,18H/b16-12-,19-13+
InChIKeyIJHUQTAULXPXKY-IYEWMPBZSA-N
MW262.31 g/mol
LogP4.22
Rot. Bonds4

About N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine

N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine (PubChem CID 135513799) has the molecular formula C17H14N2O and a molecular weight of 262.31 g/mol. Its IUPAC name is N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine.

Molecular Properties

Compound NameN-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine
PubChem CID135513799
Molecular FormulaC17H14N2O
Molecular Weight262.31 g/mol
Exact Mass262.11
IUPAC NameN-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine
SMILESC(=C(\N=C\c1ccc[nH]1)c1ccco1)\c1ccccc1
InChIInChI=1S/C17H14N2O/c1-2-6-14(7-3-1)12-16(17-9-5-11-20-17)19-13-15-8-4-10-18-15/h1-13,18H/b16-12-,19-13+
InChIKeyIJHUQTAULXPXKY-IYEWMPBZSA-N
XLogP4.22
TPSA41.29 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 54.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-benzhydryl-1-(1H-pyrrol-2-yl)methanimine
CID 136915435
[furan-2-yl(hydroxy)methylidene]chromium
CID 11728114
(E,Z)-N-[(E)-furan-2-ylmethylideneamino]-2-methyl-3-phenylprop-2-en-1-imine
CID 54606331
(E)-N-[(E)-furan-2-ylmethylideneamino]-1-phenylmethanimine
CID 46707076
N-(1H-pyrrol-2-ylmethyl)furan-2-carboxamide
CID 110374911
benzyl 2-(1H-pyrrol-2-yl)acetate
CID 175566769
furan-2-carboxylic acid;methanamine
CID 82372767
1-(furan-2-yl)-3-(1H-pyrrol-2-yl)prop-2-yn-1-one
CID 134849657
(2-oxo-1H-pyridin-3-yl) furan-2-carboxylate
CID 44583499
N-[(E)-[(Z)-3-phenylprop-2-enylidene]amino]furan-2-carboxamide
CID 92534270
2-anilino-N-[(E)-1H-pyrrol-2-ylmethylideneamino]acetamide
CID 135641150
(Z)-but-2-enedioic acid;furan-2-carboxamide
CID 161348796

Frequently Asked Questions

What is the IUPAC name of N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine?
The IUPAC name of N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine (CID 135513799) is N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine.
What is the SMILES notation for N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine?
The canonical SMILES for N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine is C(=C(\N=C\c1ccc[nH]1)c1ccco1)\c1ccccc1.
What is the InChIKey of N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine?
The InChIKey is IJHUQTAULXPXKY-IYEWMPBZSA-N. The full InChI is InChI=1S/C17H14N2O/c1-2-6-14(7-3-1)12-16(17-9-5-11-20-17)19-13-15-8-4-10-18-15/h1-13,18H/b16-12-,19-13+.
What are the key properties of N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine?
N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine has a molecular weight of 262.31 g/mol, XLogP of 4.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-1-(furan-2-yl)-2-phenylethenyl]-1-(1H-pyrrol-2-yl)methanimine is sourced from PubChem (CID 135513799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).