N-[2-amino-5-(furan-2-yl)phenyl]benzamide

C17H14N2O2 — CID 46830328

IUPACN-[2-amino-5-(furan-2-yl)phenyl]benzamide
SMILESNc1ccc(-c2ccco2)cc1NC(=O)c1ccccc1
InChIInChI=1S/C17H14N2O2/c18-14-9-8-13(16-7-4-10-21-16)11-15(14)19-17(20)12-5-2-1-3-6-12/h1-11H,18H2,(H,19,20)
InChIKeyPOPIQEQSLAJUGU-UHFFFAOYSA-N
MW278.31 g/mol
LogP3.78
Rot. Bonds3

About N-[2-amino-5-(furan-2-yl)phenyl]benzamide

N-[2-amino-5-(furan-2-yl)phenyl]benzamide (PubChem CID 46830328) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is N-[2-amino-5-(furan-2-yl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-amino-5-(furan-2-yl)phenyl]benzamide
PubChem CID46830328
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC NameN-[2-amino-5-(furan-2-yl)phenyl]benzamide
SMILESNc1ccc(-c2ccco2)cc1NC(=O)c1ccccc1
InChIInChI=1S/C17H14N2O2/c18-14-9-8-13(16-7-4-10-21-16)11-15(14)19-17(20)12-5-2-1-3-6-12/h1-11H,18H2,(H,19,20)
InChIKeyPOPIQEQSLAJUGU-UHFFFAOYSA-N
XLogP3.78
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 53.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(furan-2-yl)phenyl]benzamide?
The IUPAC name of N-[2-amino-5-(furan-2-yl)phenyl]benzamide (CID 46830328) is N-[2-amino-5-(furan-2-yl)phenyl]benzamide.
What is the SMILES notation for N-[2-amino-5-(furan-2-yl)phenyl]benzamide?
The canonical SMILES for N-[2-amino-5-(furan-2-yl)phenyl]benzamide is Nc1ccc(-c2ccco2)cc1NC(=O)c1ccccc1.
What is the InChIKey of N-[2-amino-5-(furan-2-yl)phenyl]benzamide?
The InChIKey is POPIQEQSLAJUGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c18-14-9-8-13(16-7-4-10-21-16)11-15(14)19-17(20)12-5-2-1-3-6-12/h1-11H,18H2,(H,19,20).
What are the key properties of N-[2-amino-5-(furan-2-yl)phenyl]benzamide?
N-[2-amino-5-(furan-2-yl)phenyl]benzamide has a molecular weight of 278.31 g/mol, XLogP of 3.78, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-5-(furan-2-yl)phenyl]benzamide is sourced from PubChem (CID 46830328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).