4-amino-N-(4-aminophenyl)-2-hydroxybenzamide

C13H13N3O2 — CID 18931495

IUPAC4-amino-N-(4-aminophenyl)-2-hydroxybenzamide
SMILESNc1ccc(NC(=O)c2ccc(N)cc2O)cc1
InChIInChI=1S/C13H13N3O2/c14-8-1-4-10(5-2-8)16-13(18)11-6-3-9(15)7-12(11)17/h1-7,17H,14-15H2,(H,16,18)
InChIKeyDMSLHMXRJPWJBV-UHFFFAOYSA-N
MW243.27 g/mol
LogP1.81
Rot. Bonds2

About 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide

4-amino-N-(4-aminophenyl)-2-hydroxybenzamide (PubChem CID 18931495) has the molecular formula C13H13N3O2 and a molecular weight of 243.27 g/mol. Its IUPAC name is 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide.

Molecular Properties

Compound Name4-amino-N-(4-aminophenyl)-2-hydroxybenzamide
PubChem CID18931495
Molecular FormulaC13H13N3O2
Molecular Weight243.27 g/mol
Exact Mass243.10
IUPAC Name4-amino-N-(4-aminophenyl)-2-hydroxybenzamide
SMILESNc1ccc(NC(=O)c2ccc(N)cc2O)cc1
InChIInChI=1S/C13H13N3O2/c14-8-1-4-10(5-2-8)16-13(18)11-6-3-9(15)7-12(11)17/h1-7,17H,14-15H2,(H,16,18)
InChIKeyDMSLHMXRJPWJBV-UHFFFAOYSA-N
XLogP1.81
TPSA101.37 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.27
LogP ≤ 51.81
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

4-amino-N-(4-aminophenyl)-2-cyanobenzamide
CID 19689750
N-(4-aminophenyl)-2,6-dihydroxybenzamide
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2-hydroxy-4-nitro-N-(4-nitrophenyl)benzamide
CID 18931505
2-hydroxy-N-[4-[(2-hydroxy-4-methoxybenzoyl)amino]phenyl]-4-methoxybenzamide
CID 23249025
4-amino-2-chloro-N-(4-fluorophenyl)benzamide
CID 16787993
N-(4-amino-3-bromophenyl)-2,4-dihydroxybenzamide
CID 107721508
4-amino-2-hydroxybenzoic acid;dihydrochloride
CID 140557780
N-(4-amino-3-fluorophenyl)-2,4-dihydroxybenzamide
CID 107721506
4-amino-N-(4-tert-butylphenyl)-2-chlorobenzamide
CID 28748853
2-amino-4-fluoro-N-(4-fluorophenyl)benzamide
CID 62059687
N-(4-aminophenyl)-2-selanylbenzamide
CID 137348544
4-amino-N-(2,5-dimethylpyrrol-1-yl)-2-hydroxybenzamide
CID 46837358

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide?
The IUPAC name of 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide (CID 18931495) is 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide.
What is the SMILES notation for 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide?
The canonical SMILES for 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide is Nc1ccc(NC(=O)c2ccc(N)cc2O)cc1.
What is the InChIKey of 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide?
The InChIKey is DMSLHMXRJPWJBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O2/c14-8-1-4-10(5-2-8)16-13(18)11-6-3-9(15)7-12(11)17/h1-7,17H,14-15H2,(H,16,18).
What are the key properties of 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide?
4-amino-N-(4-aminophenyl)-2-hydroxybenzamide has a molecular weight of 243.27 g/mol, XLogP of 1.81, 2 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(4-aminophenyl)-2-hydroxybenzamide is sourced from PubChem (CID 18931495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).