5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide

C13H20N2O2 — CID 61091450

IUPAC5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide
SMILESCCC(C)(C)NC(=O)c1cc(N)ccc1OC
InChIInChI=1S/C13H20N2O2/c1-5-13(2,3)15-12(16)10-8-9(14)6-7-11(10)17-4/h6-8H,5,14H2,1-4H3,(H,15,16)
InChIKeyILIUDKFZVFLJCF-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.20
Rot. Bonds4

About 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide

5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide (PubChem CID 61091450) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide.

Molecular Properties

Compound Name5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide
PubChem CID61091450
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide
SMILESCCC(C)(C)NC(=O)c1cc(N)ccc1OC
InChIInChI=1S/C13H20N2O2/c1-5-13(2,3)15-12(16)10-8-9(14)6-7-11(10)17-4/h6-8H,5,14H2,1-4H3,(H,15,16)
InChIKeyILIUDKFZVFLJCF-UHFFFAOYSA-N
XLogP2.20
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-amino-2-methoxy-N-(2-methylbutan-2-yl)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-(5-amino-2-methoxyphenoxy)-N-(2-methylbutan-2-yl)acetamide
CID 61486316
4-amino-2-chloro-N-(2-methylbutan-2-yl)benzamide
CID 16771675
3,4-dimethoxy-N-(2-methylbutan-2-yl)benzamide
CID 3297993
4-bromo-2-methoxy-N-(2-methylbutan-2-yl)benzamide
CID 78987462
tert-butyl N-[2-[(5-amino-2-methoxybenzoyl)amino]ethyl]carbamate
CID 104932681
ethyl 5-amino-2-methoxybenzoate
CID 22180184
5-amino-N-hexan-3-yl-2-methoxybenzamide
CID 62094748
5-amino-N-(4-hydroxybutyl)-2-methoxybenzamide
CID 106840078
3-[(2,5-dimethoxybenzoyl)amino]-3-methylbutanoic acid
CID 64672701
5-amino-2-methoxy-N-(2,2,3,3-tetrafluoropropyl)benzamide
CID 106289101
5-amino-N-[2-[ethyl(methyl)amino]ethyl]-2-methoxybenzamide
CID 62634324
3-amino-5-methoxy-N-(2-methylbutan-2-yl)benzamide
CID 78985037

Frequently Asked Questions

What is the IUPAC name of 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide?
The IUPAC name of 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide (CID 61091450) is 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide.
What is the SMILES notation for 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide?
The canonical SMILES for 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide is CCC(C)(C)NC(=O)c1cc(N)ccc1OC.
What is the InChIKey of 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide?
The InChIKey is ILIUDKFZVFLJCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-5-13(2,3)15-12(16)10-8-9(14)6-7-11(10)17-4/h6-8H,5,14H2,1-4H3,(H,15,16).
What are the key properties of 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide?
5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide has a molecular weight of 236.31 g/mol, XLogP of 2.20, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-2-methoxy-N-(2-methylbutan-2-yl)benzamide is sourced from PubChem (CID 61091450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).