2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide

C15H15ClN2O2 — CID 154108747

IUPAC2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide
SMILESCc1cc(O)c(NC(=O)CNc2ccccc2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-10-7-14(19)13(8-12(10)16)18-15(20)9-17-11-5-3-2-4-6-11/h2-8,17,19H,9H2,1H3,(H,18,20)
InChIKeyHFVMUZPQKXEVHR-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.40
Rot. Bonds4

About 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide

2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide (PubChem CID 154108747) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide
PubChem CID154108747
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC Name2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide
SMILESCc1cc(O)c(NC(=O)CNc2ccccc2)cc1Cl
InChIInChI=1S/C15H15ClN2O2/c1-10-7-14(19)13(8-12(10)16)18-15(20)9-17-11-5-3-2-4-6-11/h2-8,17,19H,9H2,1H3,(H,18,20)
InChIKeyHFVMUZPQKXEVHR-UHFFFAOYSA-N
XLogP3.40
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide?
The IUPAC name of 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide (CID 154108747) is 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide.
What is the SMILES notation for 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide?
The canonical SMILES for 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide is Cc1cc(O)c(NC(=O)CNc2ccccc2)cc1Cl.
What is the InChIKey of 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide?
The InChIKey is HFVMUZPQKXEVHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-10-7-14(19)13(8-12(10)16)18-15(20)9-17-11-5-3-2-4-6-11/h2-8,17,19H,9H2,1H3,(H,18,20).
What are the key properties of 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide?
2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.40, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-anilino-N-(5-chloro-2-hydroxy-4-methylphenyl)acetamide is sourced from PubChem (CID 154108747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).