2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide

C13H20N2O2 — CID 79809500

IUPAC2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide
SMILESCCC(N)(CC)C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C13H20N2O2/c1-4-13(14,5-2)12(16)15-10-7-6-8-11(9-10)17-3/h6-9H,4-5,14H2,1-3H3,(H,15,16)
InChIKeyXYQBCBVDIUXXAB-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.15
Rot. Bonds5

About 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide

2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide (PubChem CID 79809500) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide.

Molecular Properties

Compound Name2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide
PubChem CID79809500
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide
SMILESCCC(N)(CC)C(=O)Nc1cccc(OC)c1
InChIInChI=1S/C13H20N2O2/c1-4-13(14,5-2)12(16)15-10-7-6-8-11(9-10)17-3/h6-9H,4-5,14H2,1-3H3,(H,15,16)
InChIKeyXYQBCBVDIUXXAB-UHFFFAOYSA-N
XLogP2.15
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide 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-amino-N-(3-chlorophenyl)-2-ethylbutanamide
CID 79809226
3-amino-N-(3-methoxyphenyl)-3-methylbutanamide
CID 64683747
2-(2-amino-2-methylbutoxy)-N-(3-methoxyphenyl)acetamide
CID 64571888
2-hydroxy-N-(3-methoxyphenyl)-2,2-diphenylacetamide
CID 828005
2-(3-ethylpentan-3-ylamino)-N-(3-methoxyphenyl)acetamide
CID 65038567
methane;N-(3-methoxyphenyl)acetamide
CID 161026095
N-(3-fluorophenyl)-N'-(3-methoxyphenyl)-2,2-dimethylpropanediamide
CID 108969376
2-amino-N-(3-bromo-4-methoxyphenyl)-2-ethylbutanamide
CID 79813242
ethyl N-[(3-methoxyphenyl)carbamoyl]carbamate
CID 13221153
methyl 2-[3-[(2-amino-2-methylpropanoyl)amino]phenoxy]acetate;hydrochloride
CID 119284132
2-(hydroxyamino)-N-(3-methoxyphenyl)acetamide
CID 12611733
2,2-difluoro-2-(4-fluorophenyl)-N-(3-methoxyphenyl)acetamide
CID 48571112

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide?
The IUPAC name of 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide (CID 79809500) is 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide.
What is the SMILES notation for 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide?
The canonical SMILES for 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide is CCC(N)(CC)C(=O)Nc1cccc(OC)c1.
What is the InChIKey of 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide?
The InChIKey is XYQBCBVDIUXXAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-4-13(14,5-2)12(16)15-10-7-6-8-11(9-10)17-3/h6-9H,4-5,14H2,1-3H3,(H,15,16).
What are the key properties of 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide?
2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide has a molecular weight of 236.31 g/mol, XLogP of 2.15, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-ethyl-N-(3-methoxyphenyl)butanamide is sourced from PubChem (CID 79809500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).