N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide

C14H13ClN2O2 — CID 142083529

IUPACN-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide
SMILESCNc1ccc(O)cc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H13ClN2O2/c1-16-13-7-6-11(18)8-12(13)14(19)17-10-4-2-9(15)3-5-10/h2-8,16,18H,1H3,(H,17,19)
InChIKeyMUXLIFUTOHEDKY-UHFFFAOYSA-N
MW276.72 g/mol
LogP3.34
Rot. Bonds3

About N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide

N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide (PubChem CID 142083529) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide
PubChem CID142083529
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC NameN-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide
SMILESCNc1ccc(O)cc1C(=O)Nc1ccc(Cl)cc1
InChIInChI=1S/C14H13ClN2O2/c1-16-13-7-6-11(18)8-12(13)14(19)17-10-4-2-9(15)3-5-10/h2-8,16,18H,1H3,(H,17,19)
InChIKeyMUXLIFUTOHEDKY-UHFFFAOYSA-N
XLogP3.34
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 53.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-chloro-N-(4-cyanophenyl)-2-(methylamino)benzamide
CID 62166046
5-chloro-N-(3,5-dimethylphenyl)-2-(methylamino)benzamide
CID 62165706
5-chloro-N-(4-chlorophenyl)-2-(ethylamino)benzamide
CID 63501473
5-chloro-N-(4-chloro-3-methoxyphenyl)-2-(methylamino)benzamide
CID 107623034
N-(3-bromo-5-methylphenyl)-5-chloro-2-(methylamino)benzamide
CID 107578575
2-[(4-chloro-2-hydroxybenzoyl)amino]-5-hydroxybenzoic acid
CID 61405727
N-(4-chlorophenyl)-2-(methylamino)pyridine-3-carboxamide
CID 62167597
2,4-dichloro-N-(4-hydroxy-2-methylphenyl)benzamide
CID 849254
5-chloro-N-(2,5-difluorophenyl)-2-(methylamino)benzamide
CID 62172768
N-(4-chlorophenyl)-4-(methylamino)benzamide
CID 62166017
N-(3,5-dichlorophenyl)-2,5-dihydroxybenzamide
CID 107722277
2-chloro-N-(4-chlorophenyl)-5-methylbenzamide
CID 122630204

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide?
The IUPAC name of N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide (CID 142083529) is N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide.
What is the SMILES notation for N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide?
The canonical SMILES for N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide is CNc1ccc(O)cc1C(=O)Nc1ccc(Cl)cc1.
What is the InChIKey of N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide?
The InChIKey is MUXLIFUTOHEDKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-16-13-7-6-11(18)8-12(13)14(19)17-10-4-2-9(15)3-5-10/h2-8,16,18H,1H3,(H,17,19).
What are the key properties of N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide?
N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide has a molecular weight of 276.72 g/mol, XLogP of 3.34, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-5-hydroxy-2-(methylamino)benzamide is sourced from PubChem (CID 142083529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).