N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide

C15H24N4O2 — CID 43588199

IUPACN-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide
SMILESCCN(CC(=O)Nc1ccc(N)cc1C)CC(=O)N(C)C
InChIInChI=1S/C15H24N4O2/c1-5-19(10-15(21)18(3)4)9-14(20)17-13-7-6-12(16)8-11(13)2/h6-8H,5,9-10,16H2,1-4H3,(H,17,20)
InChIKeyZBMJOCPNKKPHAX-UHFFFAOYSA-N
MW292.38 g/mol
LogP0.93
Rot. Bonds6

About N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide

N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide (PubChem CID 43588199) has the molecular formula C15H24N4O2 and a molecular weight of 292.38 g/mol. Its IUPAC name is N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide.

Molecular Properties

Compound NameN-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide
PubChem CID43588199
Molecular FormulaC15H24N4O2
Molecular Weight292.38 g/mol
Exact Mass292.19
IUPAC NameN-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide
SMILESCCN(CC(=O)Nc1ccc(N)cc1C)CC(=O)N(C)C
InChIInChI=1S/C15H24N4O2/c1-5-19(10-15(21)18(3)4)9-14(20)17-13-7-6-12(16)8-11(13)2/h6-8H,5,9-10,16H2,1-4H3,(H,17,20)
InChIKeyZBMJOCPNKKPHAX-UHFFFAOYSA-N
XLogP0.93
TPSA78.67 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.38
LogP ≤ 50.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2-[[2-(4-amino-2-methylanilino)-2-oxoethyl]-methylamino]-N-methylacetamide
CID 43374519
N-(4-amino-2-methylphenyl)propanamide
CID 839309
N-(4-amino-2-methylphenyl)-2-[butyl(2-hydroxyethyl)amino]acetamide
CID 61444232
2-(diethylamino)-N-(2,4-dimethylphenyl)acetamide
CID 28447
N-(4-amino-2-methylphenyl)-3-[methyl(propyl)amino]propanamide
CID 43270832
3-(4-amino-2-methylphenyl)-1-ethyl-1-methylurea
CID 79152927
N-(4-amino-2-methylphenyl)-4-(dipropylamino)butanamide
CID 16779092
2-[[2-(4-amino-2-methoxyanilino)-2-oxoethyl]-ethylamino]-N-methylacetamide
CID 43574894
2-[[2-(dimethylamino)-2-oxoethyl]-methylamino]-N-(2,4-dimethylphenyl)acetamide
CID 8712055
N-(4-chloro-2-methylphenyl)-2-(diethylamino)acetamide;hydrochloride
CID 131885103
N-(5-amino-2-methylphenyl)-2-[ethyl-(2-hydroxy-2-methylpropyl)amino]acetamide
CID 79384794
2-[[2-(4-amino-2-methylanilino)-2-oxoethyl]-methylamino]-N-cyclopropylacetamide
CID 43574823

Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide?
The IUPAC name of N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide (CID 43588199) is N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide.
What is the SMILES notation for N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide?
The canonical SMILES for N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide is CCN(CC(=O)Nc1ccc(N)cc1C)CC(=O)N(C)C.
What is the InChIKey of N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide?
The InChIKey is ZBMJOCPNKKPHAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O2/c1-5-19(10-15(21)18(3)4)9-14(20)17-13-7-6-12(16)8-11(13)2/h6-8H,5,9-10,16H2,1-4H3,(H,17,20).
What are the key properties of N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide?
N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide has a molecular weight of 292.38 g/mol, XLogP of 0.93, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2-methylphenyl)-2-[[2-(dimethylamino)-2-oxoethyl]-ethylamino]acetamide is sourced from PubChem (CID 43588199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).