N-(5-amino-2-hydroxyphenyl)benzamide

C13H12N2O2 — CID 16728382

IUPACN-(5-amino-2-hydroxyphenyl)benzamide
SMILESNc1ccc(O)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C13H12N2O2/c14-10-6-7-12(16)11(8-10)15-13(17)9-4-2-1-3-5-9/h1-8,16H,14H2,(H,15,17)
InChIKeyMPNBDDQCWMLNAP-UHFFFAOYSA-N
MW228.25 g/mol
LogP2.23
Rot. Bonds2

About N-(5-amino-2-hydroxyphenyl)benzamide

N-(5-amino-2-hydroxyphenyl)benzamide (PubChem CID 16728382) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is N-(5-amino-2-hydroxyphenyl)benzamide.

Molecular Properties

Compound NameN-(5-amino-2-hydroxyphenyl)benzamide
PubChem CID16728382
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC NameN-(5-amino-2-hydroxyphenyl)benzamide
SMILESNc1ccc(O)c(NC(=O)c2ccccc2)c1
InChIInChI=1S/C13H12N2O2/c14-10-6-7-12(16)11(8-10)15-13(17)9-4-2-1-3-5-9/h1-8,16H,14H2,(H,15,17)
InChIKeyMPNBDDQCWMLNAP-UHFFFAOYSA-N
XLogP2.23
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 52.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(5-amino-2-hydroxyphenyl)benzamide?
The IUPAC name of N-(5-amino-2-hydroxyphenyl)benzamide (CID 16728382) is N-(5-amino-2-hydroxyphenyl)benzamide.
What is the SMILES notation for N-(5-amino-2-hydroxyphenyl)benzamide?
The canonical SMILES for N-(5-amino-2-hydroxyphenyl)benzamide is Nc1ccc(O)c(NC(=O)c2ccccc2)c1.
What is the InChIKey of N-(5-amino-2-hydroxyphenyl)benzamide?
The InChIKey is MPNBDDQCWMLNAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c14-10-6-7-12(16)11(8-10)15-13(17)9-4-2-1-3-5-9/h1-8,16H,14H2,(H,15,17).
What are the key properties of N-(5-amino-2-hydroxyphenyl)benzamide?
N-(5-amino-2-hydroxyphenyl)benzamide has a molecular weight of 228.25 g/mol, XLogP of 2.23, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-amino-2-hydroxyphenyl)benzamide is sourced from PubChem (CID 16728382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).