N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide

C15H25N3O — CID 43376005

IUPACN-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1N)CC(C)C
InChIInChI=1S/C15H25N3O/c1-5-18(9-11(2)3)10-15(19)17-14-7-6-12(4)8-13(14)16/h6-8,11H,5,9-10,16H2,1-4H3,(H,17,19)
InChIKeyKXPZPQRPMDDXOE-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.49
Rot. Bonds6

About N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide

N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide (PubChem CID 43376005) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide.

Molecular Properties

Compound NameN-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide
PubChem CID43376005
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide
SMILESCCN(CC(=O)Nc1ccc(C)cc1N)CC(C)C
InChIInChI=1S/C15H25N3O/c1-5-18(9-11(2)3)10-15(19)17-14-7-6-12(4)8-13(14)16/h6-8,11H,5,9-10,16H2,1-4H3,(H,17,19)
InChIKeyKXPZPQRPMDDXOE-UHFFFAOYSA-N
XLogP2.49
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(propyl)amino]acetamide
CID 61424715
N-(3-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide
CID 43376006
N-(2-amino-4-methylphenyl)-2-[bis(cyanomethyl)amino]acetamide
CID 43375756
N-(2-amino-4-chlorophenyl)-3-[ethyl(2-methylpropyl)amino]propanamide
CID 43273330
2-(diethylamino)-N-(2,4-dimethylphenyl)acetamide
CID 28447
N-(2-amino-4-methylphenyl)-3-methylpentanamide
CID 114873461
N-(2-amino-4-methylphenyl)-2-(2-methylpropoxy)acetamide
CID 43376605
(2R)-N-(2-amino-4-methylphenyl)-2-methylbutanamide
CID 40788863
N-(2-amino-4-methylphenyl)-2-[methyl(2-propan-2-yloxyethyl)amino]acetamide
CID 81059349
N-(2-amino-4-methylphenyl)-2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]acetamide
CID 107478740
N-(2-amino-4-methylphenyl)-2-butan-2-yloxyacetamide
CID 54943807
N-(2-amino-4-methylphenyl)-2-propan-2-ylsulfinylacetamide
CID 61289452

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide?
The IUPAC name of N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide (CID 43376005) is N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide.
What is the SMILES notation for N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide?
The canonical SMILES for N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide is CCN(CC(=O)Nc1ccc(C)cc1N)CC(C)C.
What is the InChIKey of N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide?
The InChIKey is KXPZPQRPMDDXOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-18(9-11(2)3)10-15(19)17-14-7-6-12(4)8-13(14)16/h6-8,11H,5,9-10,16H2,1-4H3,(H,17,19).
What are the key properties of N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide?
N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.49, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-4-methylphenyl)-2-[ethyl(2-methylpropyl)amino]acetamide is sourced from PubChem (CID 43376005), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).