2-(4-aminophenoxy)-4-methylbenzamide

C14H14N2O2 — CID 62308033

IUPAC2-(4-aminophenoxy)-4-methylbenzamide
SMILESCc1ccc(C(N)=O)c(Oc2ccc(N)cc2)c1
InChIInChI=1S/C14H14N2O2/c1-9-2-7-12(14(16)17)13(8-9)18-11-5-3-10(15)4-6-11/h2-8H,15H2,1H3,(H2,16,17)
InChIKeyDCSBXNQYIRLZHJ-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.47
Rot. Bonds3

About 2-(4-aminophenoxy)-4-methylbenzamide

2-(4-aminophenoxy)-4-methylbenzamide (PubChem CID 62308033) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 2-(4-aminophenoxy)-4-methylbenzamide.

Molecular Properties

Compound Name2-(4-aminophenoxy)-4-methylbenzamide
PubChem CID62308033
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name2-(4-aminophenoxy)-4-methylbenzamide
SMILESCc1ccc(C(N)=O)c(Oc2ccc(N)cc2)c1
InChIInChI=1S/C14H14N2O2/c1-9-2-7-12(14(16)17)13(8-9)18-11-5-3-10(15)4-6-11/h2-8H,15H2,1H3,(H2,16,17)
InChIKeyDCSBXNQYIRLZHJ-UHFFFAOYSA-N
XLogP2.47
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.28
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenoxy)-4-methylbenzamide?
The IUPAC name of 2-(4-aminophenoxy)-4-methylbenzamide (CID 62308033) is 2-(4-aminophenoxy)-4-methylbenzamide.
What is the SMILES notation for 2-(4-aminophenoxy)-4-methylbenzamide?
The canonical SMILES for 2-(4-aminophenoxy)-4-methylbenzamide is Cc1ccc(C(N)=O)c(Oc2ccc(N)cc2)c1.
What is the InChIKey of 2-(4-aminophenoxy)-4-methylbenzamide?
The InChIKey is DCSBXNQYIRLZHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-9-2-7-12(14(16)17)13(8-9)18-11-5-3-10(15)4-6-11/h2-8H,15H2,1H3,(H2,16,17).
What are the key properties of 2-(4-aminophenoxy)-4-methylbenzamide?
2-(4-aminophenoxy)-4-methylbenzamide has a molecular weight of 242.28 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenoxy)-4-methylbenzamide is sourced from PubChem (CID 62308033), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).