N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide

C14H23N3O2 — CID 61424715

IUPACN-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
SMILESCCCN(CCO)CC(=O)Nc1ccc(C)cc1N
InChIInChI=1S/C14H23N3O2/c1-3-6-17(7-8-18)10-14(19)16-13-5-4-11(2)9-12(13)15/h4-5,9,18H,3,6-8,10,15H2,1-2H3,(H,16,19)
InChIKeyYMNSAFCHYZHGAA-UHFFFAOYSA-N
MW265.36 g/mol
LogP1.22
Rot. Bonds7

About N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide

N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide (PubChem CID 61424715) has the molecular formula C14H23N3O2 and a molecular weight of 265.36 g/mol. Its IUPAC name is N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
PubChem CID61424715
Molecular FormulaC14H23N3O2
Molecular Weight265.36 g/mol
Exact Mass265.18
IUPAC NameN-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
SMILESCCCN(CCO)CC(=O)Nc1ccc(C)cc1N
InChIInChI=1S/C14H23N3O2/c1-3-6-17(7-8-18)10-14(19)16-13-5-4-11(2)9-12(13)15/h4-5,9,18H,3,6-8,10,15H2,1-2H3,(H,16,19)
InChIKeyYMNSAFCHYZHGAA-UHFFFAOYSA-N
XLogP1.22
TPSA78.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 51.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]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

N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetamide
CID 107478740
N-(2-amino-4-methylphenyl)-2-[bis(cyanomethyl)amino]acetamide
CID 43375756
N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide
CID 43376005
N-(4-amino-2-methylphenyl)-2-[butyl(2-hydroxyethyl)amino]acetamide
CID 61444232
N-(2-aminophenyl)-2-[bis(2-hydroxyethyl)amino]acetamide
CID 61242990
N-(5-fluoro-2-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 60693543
N-(4-aminophenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 61425121
N-(2,4-dimethylphenyl)-2-[2-hydroxyethyl(2-methoxyethyl)amino]acetamide
CID 111103230
N-(2-amino-5-chlorophenyl)-2-[bis(2-hydroxyethyl)amino]acetamide
CID 61243364
3-[[2-(2,5-dimethylanilino)-2-oxoethyl]-propylamino]propanoic acid
CID 82326667
3-[[2-(2-amino-4-methylanilino)-2-oxoethyl]-methylamino]-N-methylpropanamide
CID 106914557
3-[[2-(2,5-dimethylanilino)-2-oxoethyl]-(2-hydroxyethyl)amino]propanoic acid
CID 82326666

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The IUPAC name of N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide (CID 61424715) is N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide.
What is the SMILES notation for N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The canonical SMILES for N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide is CCCN(CCO)CC(=O)Nc1ccc(C)cc1N.
What is the InChIKey of N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
The InChIKey is YMNSAFCHYZHGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3O2/c1-3-6-17(7-8-18)10-14(19)16-13-5-4-11(2)9-12(13)15/h4-5,9,18H,3,6-8,10,15H2,1-2H3,(H,16,19).
What are the key properties of N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide?
N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide has a molecular weight of 265.36 g/mol, XLogP of 1.22, 7 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide is sourced from PubChem (CID 61424715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).