2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide

C19H24N2O3 — CID 119715039

IUPAC2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide
SMILESCCCCOc1ccc(OC)cc1NC(=O)Cc1ccc(N)cc1
InChIInChI=1S/C19H24N2O3/c1-3-4-11-24-18-10-9-16(23-2)13-17(18)21-19(22)12-14-5-7-15(20)8-6-14/h5-10,13H,3-4,11-12,20H2,1-2H3,(H,21,22)
InChIKeyIKQQAKNEXQGAGJ-UHFFFAOYSA-N
MW328.41 g/mol
LogP3.64
Rot. Bonds8

About 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide

2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide (PubChem CID 119715039) has the molecular formula C19H24N2O3 and a molecular weight of 328.41 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide
PubChem CID119715039
Molecular FormulaC19H24N2O3
Molecular Weight328.41 g/mol
Exact Mass328.18
IUPAC Name2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide
SMILESCCCCOc1ccc(OC)cc1NC(=O)Cc1ccc(N)cc1
InChIInChI=1S/C19H24N2O3/c1-3-4-11-24-18-10-9-16(23-2)13-17(18)21-19(22)12-14-5-7-15(20)8-6-14/h5-10,13H,3-4,11-12,20H2,1-2H3,(H,21,22)
InChIKeyIKQQAKNEXQGAGJ-UHFFFAOYSA-N
XLogP3.64
TPSA73.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.41
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide 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-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide;hydrochloride
CID 119715038
3-(2-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)propanamide;hydrochloride
CID 120608796
4-(aminomethyl)-N-(2-butoxy-5-methoxyphenyl)benzamide;hydrochloride
CID 119284799
3-amino-N-(2-butoxy-5-methoxyphenyl)benzamide;hydrochloride
CID 119715062
2-(4-methoxyphenyl)-N-[2-propoxy-5-(trifluoromethyl)phenyl]acetamide
CID 8800716
N-(2-butoxy-5-methoxyphenyl)-2-(2,5-dimethylphenoxy)acetamide
CID 35366389
2-(4-aminophenyl)-N-[5-chloro-2-(2-ethoxyethoxy)phenyl]acetamide
CID 119773164
2-(1,2-benzoxazol-3-yl)-N-(2-butoxy-5-methoxyphenyl)acetamide
CID 46441550
N-(2-butoxy-5-methoxyphenyl)-2-(2-oxopiperidin-1-yl)acetamide
CID 78864329
N-(2-butoxy-5-methoxyphenyl)-2-methylsulfanylpropanamide
CID 47328777
N-(2,5-dimethoxyphenyl)hexadecanamide
CID 20789890
N-(2,5-dimethoxyphenyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 24535021

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide (CID 119715039) is 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide is CCCCOc1ccc(OC)cc1NC(=O)Cc1ccc(N)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide?
The InChIKey is IKQQAKNEXQGAGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3/c1-3-4-11-24-18-10-9-16(23-2)13-17(18)21-19(22)12-14-5-7-15(20)8-6-14/h5-10,13H,3-4,11-12,20H2,1-2H3,(H,21,22).
What are the key properties of 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide?
2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide has a molecular weight of 328.41 g/mol, XLogP of 3.64, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(2-butoxy-5-methoxyphenyl)acetamide is sourced from PubChem (CID 119715039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).