N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide

C19H15FN2O — CID 46830345

IUPACN-[2-amino-5-(4-fluorophenyl)phenyl]benzamide
SMILESNc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccccc1
InChIInChI=1S/C19H15FN2O/c20-16-9-6-13(7-10-16)15-8-11-17(21)18(12-15)22-19(23)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,23)
InChIKeyLKRDHRWKHHRCOQ-UHFFFAOYSA-N
MW306.34 g/mol
LogP4.33
Rot. Bonds3

About N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide

N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide (PubChem CID 46830345) has the molecular formula C19H15FN2O and a molecular weight of 306.34 g/mol. Its IUPAC name is N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide.

Molecular Properties

Compound NameN-[2-amino-5-(4-fluorophenyl)phenyl]benzamide
PubChem CID46830345
Molecular FormulaC19H15FN2O
Molecular Weight306.34 g/mol
Exact Mass306.12
IUPAC NameN-[2-amino-5-(4-fluorophenyl)phenyl]benzamide
SMILESNc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccccc1
InChIInChI=1S/C19H15FN2O/c20-16-9-6-13(7-10-16)15-8-11-17(21)18(12-15)22-19(23)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,23)
InChIKeyLKRDHRWKHHRCOQ-UHFFFAOYSA-N
XLogP4.33
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.34
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Tacedinaline
CID 2746
Dinaline
CID 42725
4,5-Dianilinophthalimide
CID 1697
N-(2-aminophenyl)benzamide
CID 759408
T-226296
CID 9865843
3-Aminobenzanilide
CID 84347
Brd3308
CID 72734382
Cgp53353
CID 6711154
N-(2-fluorophenyl)naphthalene-2-carboxamide
CID 883701
4'-Benzoylbenzanilide
CID 88168
N-(4-Fluorophenyl)benzamide
CID 242889
2-Benzoylaminobiphenyl
CID 345522

Frequently Asked Questions

What is the IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide?
The IUPAC name of N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide (CID 46830345) is N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide.
What is the SMILES notation for N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide?
The canonical SMILES for N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide is Nc1ccc(-c2ccc(F)cc2)cc1NC(=O)c1ccccc1.
What is the InChIKey of N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide?
The InChIKey is LKRDHRWKHHRCOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FN2O/c20-16-9-6-13(7-10-16)15-8-11-17(21)18(12-15)22-19(23)14-4-2-1-3-5-14/h1-12H,21H2,(H,22,23).
What are the key properties of N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide?
N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide has a molecular weight of 306.34 g/mol, XLogP of 4.33, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-amino-5-(4-fluorophenyl)phenyl]benzamide is sourced from PubChem (CID 46830345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).