4-(4-amino-3-methylphenoxy)benzamide

C14H14N2O2 — CID 43381706

IUPAC4-(4-amino-3-methylphenoxy)benzamide
SMILESCc1cc(Oc2ccc(C(N)=O)cc2)ccc1N
InChIInChI=1S/C14H14N2O2/c1-9-8-12(6-7-13(9)15)18-11-4-2-10(3-5-11)14(16)17/h2-8H,15H2,1H3,(H2,16,17)
InChIKeyWCCJUCHCWWTWBT-UHFFFAOYSA-N
MW242.28 g/mol
LogP2.47
Rot. Bonds3

About 4-(4-amino-3-methylphenoxy)benzamide

4-(4-amino-3-methylphenoxy)benzamide (PubChem CID 43381706) has the molecular formula C14H14N2O2 and a molecular weight of 242.28 g/mol. Its IUPAC name is 4-(4-amino-3-methylphenoxy)benzamide.

Molecular Properties

Compound Name4-(4-amino-3-methylphenoxy)benzamide
PubChem CID43381706
Molecular FormulaC14H14N2O2
Molecular Weight242.28 g/mol
Exact Mass242.11
IUPAC Name4-(4-amino-3-methylphenoxy)benzamide
SMILESCc1cc(Oc2ccc(C(N)=O)cc2)ccc1N
InChIInChI=1S/C14H14N2O2/c1-9-8-12(6-7-13(9)15)18-11-4-2-10(3-5-11)14(16)17/h2-8H,15H2,1H3,(H2,16,17)
InChIKeyWCCJUCHCWWTWBT-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': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-amino-5-(4-carbamoylphenoxy)benzoic acid
CID 60986679
4-(4-carbamoylphenoxy)benzamide
CID 156597124
4-(4-amino-3-methylphenoxy)phenol
CID 150102226
methyl 2-amino-5-(3,4-dimethylphenoxy)benzoate
CID 63423501
4-[7-(4-amino-3-methylphenoxy)naphthalen-2-yl]oxy-2-methylaniline
CID 139654231
4-(4-ethylphenoxy)-2-methylaniline
CID 26190351
4-(4-hydroxyphenoxy)benzamide
CID 60869896
4-amino-3-(4-carbamoylphenoxy)benzoic acid
CID 82796681
4-[4-(hydrazinecarbonyl)phenoxy]benzamide
CID 145084998
4-(4-amino-3-methylphenoxy)-2-methylbenzonitrile
CID 81279568
3-(3,4-dimethylphenoxy)-5-methylbenzamide
CID 143152048
2-amino-5-(4-bromo-3-methylphenoxy)benzoic acid
CID 83134573

Frequently Asked Questions

What is the IUPAC name of 4-(4-amino-3-methylphenoxy)benzamide?
The IUPAC name of 4-(4-amino-3-methylphenoxy)benzamide (CID 43381706) is 4-(4-amino-3-methylphenoxy)benzamide.
What is the SMILES notation for 4-(4-amino-3-methylphenoxy)benzamide?
The canonical SMILES for 4-(4-amino-3-methylphenoxy)benzamide is Cc1cc(Oc2ccc(C(N)=O)cc2)ccc1N.
What is the InChIKey of 4-(4-amino-3-methylphenoxy)benzamide?
The InChIKey is WCCJUCHCWWTWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-9-8-12(6-7-13(9)15)18-11-4-2-10(3-5-11)14(16)17/h2-8H,15H2,1H3,(H2,16,17).
What are the key properties of 4-(4-amino-3-methylphenoxy)benzamide?
4-(4-amino-3-methylphenoxy)benzamide 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 4-(4-amino-3-methylphenoxy)benzamide is sourced from PubChem (CID 43381706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).