N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide

C15H15ClN2O2 — CID 104667363

IUPACN-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide
SMILESCc1cc(N)c(Cl)cc1NC(=O)Cc1cccc(O)c1
InChIInChI=1S/C15H15ClN2O2/c1-9-5-13(17)12(16)8-14(9)18-15(20)7-10-3-2-4-11(19)6-10/h2-6,8,19H,7,17H2,1H3,(H,18,20)
InChIKeySSIRMNAVPVZHCU-UHFFFAOYSA-N
MW290.75 g/mol
LogP3.12
Rot. Bonds3

About N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide

N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide (PubChem CID 104667363) has the molecular formula C15H15ClN2O2 and a molecular weight of 290.75 g/mol. Its IUPAC name is N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide.

Molecular Properties

Compound NameN-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide
PubChem CID104667363
Molecular FormulaC15H15ClN2O2
Molecular Weight290.75 g/mol
Exact Mass290.08
IUPAC NameN-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide
SMILESCc1cc(N)c(Cl)cc1NC(=O)Cc1cccc(O)c1
InChIInChI=1S/C15H15ClN2O2/c1-9-5-13(17)12(16)8-14(9)18-15(20)7-10-3-2-4-11(19)6-10/h2-6,8,19H,7,17H2,1H3,(H,18,20)
InChIKeySSIRMNAVPVZHCU-UHFFFAOYSA-N
XLogP3.12
TPSA75.35 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.75
LogP ≤ 53.12
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide?
The IUPAC name of N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide (CID 104667363) is N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide.
What is the SMILES notation for N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide?
The canonical SMILES for N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide is Cc1cc(N)c(Cl)cc1NC(=O)Cc1cccc(O)c1.
What is the InChIKey of N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide?
The InChIKey is SSIRMNAVPVZHCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15ClN2O2/c1-9-5-13(17)12(16)8-14(9)18-15(20)7-10-3-2-4-11(19)6-10/h2-6,8,19H,7,17H2,1H3,(H,18,20).
What are the key properties of N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide?
N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide has a molecular weight of 290.75 g/mol, XLogP of 3.12, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-5-chloro-2-methylphenyl)-2-(3-hydroxyphenyl)acetamide is sourced from PubChem (CID 104667363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).