2-amino-5-(2-butan-2-ylphenoxy)benzamide

C17H20N2O2 — CID 61305596

IUPAC2-amino-5-(2-butan-2-ylphenoxy)benzamide
SMILESCCC(C)c1ccccc1Oc1ccc(N)c(C(N)=O)c1
InChIInChI=1S/C17H20N2O2/c1-3-11(2)13-6-4-5-7-16(13)21-12-8-9-15(18)14(10-12)17(19)20/h4-11H,3,18H2,1-2H3,(H2,19,20)
InChIKeyILRZLZHOGRSBPF-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.67
Rot. Bonds5

About 2-amino-5-(2-butan-2-ylphenoxy)benzamide

2-amino-5-(2-butan-2-ylphenoxy)benzamide (PubChem CID 61305596) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-5-(2-butan-2-ylphenoxy)benzamide.

Molecular Properties

Compound Name2-amino-5-(2-butan-2-ylphenoxy)benzamide
PubChem CID61305596
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-amino-5-(2-butan-2-ylphenoxy)benzamide
SMILESCCC(C)c1ccccc1Oc1ccc(N)c(C(N)=O)c1
InChIInChI=1S/C17H20N2O2/c1-3-11(2)13-6-4-5-7-16(13)21-12-8-9-15(18)14(10-12)17(19)20/h4-11H,3,18H2,1-2H3,(H2,19,20)
InChIKeyILRZLZHOGRSBPF-UHFFFAOYSA-N
XLogP3.67
TPSA78.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-5-(2-butan-2-ylphenoxy)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-4-(2-butan-2-ylphenoxy)benzenecarboximidamide
CID 107279485
2-amino-5-(5-methyl-2-propan-2-ylphenoxy)benzamide
CID 61311722
2-amino-5-(2-fluoro-3-methylphenoxy)benzamide
CID 107659972
2-amino-5-[2-(trifluoromethyl)phenoxy]benzamide
CID 61312851
4-(2-butan-2-ylphenoxy)pyridine-2-carboxylic acid
CID 43326012
5-amino-6-(2-butan-2-ylphenoxy)pyridine-2-carboxylic acid
CID 114408523
2-amino-5-(4-butan-2-ylphenoxy)benzoic acid
CID 107667442
3-(2-butan-2-ylphenoxy)-5-fluoroaniline
CID 80752812
2-amino-5-[(2-ethyl-6-methyl-3-pyridinyl)oxy]benzamide
CID 103175349
2-amino-5-(4-methylpentan-2-yloxy)benzamide
CID 55139339
methyl 2-amino-5-(2-methoxyphenoxy)benzoate
CID 61306841
4-[2-[(1R)-1-hydroxypropyl]phenoxy]benzamide
CID 103960520

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(2-butan-2-ylphenoxy)benzamide?
The IUPAC name of 2-amino-5-(2-butan-2-ylphenoxy)benzamide (CID 61305596) is 2-amino-5-(2-butan-2-ylphenoxy)benzamide.
What is the SMILES notation for 2-amino-5-(2-butan-2-ylphenoxy)benzamide?
The canonical SMILES for 2-amino-5-(2-butan-2-ylphenoxy)benzamide is CCC(C)c1ccccc1Oc1ccc(N)c(C(N)=O)c1.
What is the InChIKey of 2-amino-5-(2-butan-2-ylphenoxy)benzamide?
The InChIKey is ILRZLZHOGRSBPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-11(2)13-6-4-5-7-16(13)21-12-8-9-15(18)14(10-12)17(19)20/h4-11H,3,18H2,1-2H3,(H2,19,20).
What are the key properties of 2-amino-5-(2-butan-2-ylphenoxy)benzamide?
2-amino-5-(2-butan-2-ylphenoxy)benzamide has a molecular weight of 284.36 g/mol, XLogP of 3.67, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(2-butan-2-ylphenoxy)benzamide is sourced from PubChem (CID 61305596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).