4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline

C18H16N2O — CID 154398154

IUPAC4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline
SMILESNc1ccc(C=Cc2ccc(-c3ccc(N)cc3)o2)cc1
InChIInChI=1S/C18H16N2O/c19-15-6-1-13(2-7-15)3-10-17-11-12-18(21-17)14-4-8-16(20)9-5-14/h1-12H,19-20H2
InChIKeyGUWIFQWLHIHTPL-UHFFFAOYSA-N
MW276.34 g/mol
LogP4.28
Rot. Bonds3

About 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline

4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline (PubChem CID 154398154) has the molecular formula C18H16N2O and a molecular weight of 276.34 g/mol. Its IUPAC name is 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline.

Molecular Properties

Compound Name4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline
PubChem CID154398154
Molecular FormulaC18H16N2O
Molecular Weight276.34 g/mol
Exact Mass276.13
IUPAC Name4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline
SMILESNc1ccc(C=Cc2ccc(-c3ccc(N)cc3)o2)cc1
InChIInChI=1S/C18H16N2O/c19-15-6-1-13(2-7-15)3-10-17-11-12-18(21-17)14-4-8-16(20)9-5-14/h1-12H,19-20H2
InChIKeyGUWIFQWLHIHTPL-UHFFFAOYSA-N
XLogP4.28
TPSA65.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 54.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-phenyl-5-[(Z)-2-(5-phenylfuran-2-yl)ethenyl]furan
CID 11381399
[4-[2-[5-[4-(2-methylprop-2-enoyloxy)phenyl]furan-2-yl]ethenyl]phenyl] 2-methylprop-2-enoate
CID 123286477
5-(4-formylphenyl)furan-2-carbaldehyde
CID 7183276
4-[(E)-2-[5-(4-nitrophenyl)furan-2-yl]ethenyl]pyridine
CID 5345969
4-(5-methylfuran-2-yl)aniline;hydrochloride
CID 2859134
2-[2-(5-phenylfuran-2-yl)ethenyl]anthracene-9,10-dione
CID 3292612
4-[2-[5-(2-aminophenyl)furan-2-yl]ethenyl]benzonitrile
CID 71389508
4-[(1E,3E)-4-[4-[(1E,3E)-4-(4-aminophenyl)buta-1,3-dienyl]phenyl]buta-1,3-dienyl]aniline
CID 18428969
4-[2-[4,5-bis(4-aminophenyl)-1,3-oxazol-2-yl]ethenyl]aniline
CID 71335046
4-[2-(4-aminophenyl)ethenyl]aniline;ethanamine
CID 73474151
4-[(Z)-2-(4-aminophenyl)ethenyl]phenol
CID 25021233
4-[(E)-2-(4-bromophenyl)ethenyl]aniline
CID 165349864

Frequently Asked Questions

What is the IUPAC name of 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline?
The IUPAC name of 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline (CID 154398154) is 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline.
What is the SMILES notation for 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline?
The canonical SMILES for 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline is Nc1ccc(C=Cc2ccc(-c3ccc(N)cc3)o2)cc1.
What is the InChIKey of 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline?
The InChIKey is GUWIFQWLHIHTPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O/c19-15-6-1-13(2-7-15)3-10-17-11-12-18(21-17)14-4-8-16(20)9-5-14/h1-12H,19-20H2.
What are the key properties of 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline?
4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline has a molecular weight of 276.34 g/mol, XLogP of 4.28, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[5-(4-aminophenyl)furan-2-yl]ethenyl]aniline is sourced from PubChem (CID 154398154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).