N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide

C15H25N3O — CID 43375942

IUPACN-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide
SMILESCCCN(CC(=O)N(C)c1ccc(N)cc1)C(C)C
InChIInChI=1S/C15H25N3O/c1-5-10-18(12(2)3)11-15(19)17(4)14-8-6-13(16)7-9-14/h6-9,12H,5,10-11,16H2,1-4H3
InChIKeyQNCPCEYJGQKGHW-UHFFFAOYSA-N
MW263.38 g/mol
LogP2.35
Rot. Bonds6

About N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide

N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide (PubChem CID 43375942) has the molecular formula C15H25N3O and a molecular weight of 263.38 g/mol. Its IUPAC name is N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide.

Molecular Properties

Compound NameN-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide
PubChem CID43375942
Molecular FormulaC15H25N3O
Molecular Weight263.38 g/mol
Exact Mass263.20
IUPAC NameN-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide
SMILESCCCN(CC(=O)N(C)c1ccc(N)cc1)C(C)C
InChIInChI=1S/C15H25N3O/c1-5-10-18(12(2)3)11-15(19)17(4)14-8-6-13(16)7-9-14/h6-9,12H,5,10-11,16H2,1-4H3
InChIKeyQNCPCEYJGQKGHW-UHFFFAOYSA-N
XLogP2.35
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(4-aminophenyl)-2-[ethyl(propan-2-yl)amino]-N-methylacetamide
CID 43375898
N-(4-aminophenyl)-2-[methoxy(methyl)amino]-N-methylacetamide
CID 43627611
N-(4-aminophenyl)-2-[3-(dimethylamino)propyl-methylamino]-N-methylacetamide
CID 63693206
N-(4-aminophenyl)-N-methyl-2-pentan-2-yloxyacetamide
CID 102980773
N-(4-aminophenyl)-3-(dimethylamino)-N-methylpropanamide
CID 23506938
N-(4-aminophenyl)-2-[ethyl(2-methoxyethyl)amino]-N-methylacetamide
CID 61444480
N-(4-aminophenyl)-N,2-dimethylbutanamide
CID 43114423
N-(4-aminophenyl)-N-methyl-2-propan-2-ylsulfinylacetamide
CID 61289454
3-[[2-(4-amino-N-methylanilino)-2-oxoethyl]-methylamino]-N,2-dimethylpropanamide
CID 106914693
N-(3-aminopropyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide
CID 43269272
N-(4-aminophenyl)-2-[(2-hydroxy-2-methylpropyl)-methylamino]-N-methylacetamide
CID 79383876
2-(4-amino-N-propylanilino)propanamide
CID 63233906

Frequently Asked Questions

What is the IUPAC name of N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide?
The IUPAC name of N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide (CID 43375942) is N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide.
What is the SMILES notation for N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide?
The canonical SMILES for N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide is CCCN(CC(=O)N(C)c1ccc(N)cc1)C(C)C.
What is the InChIKey of N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide?
The InChIKey is QNCPCEYJGQKGHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3O/c1-5-10-18(12(2)3)11-15(19)17(4)14-8-6-13(16)7-9-14/h6-9,12H,5,10-11,16H2,1-4H3.
What are the key properties of N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide?
N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide has a molecular weight of 263.38 g/mol, XLogP of 2.35, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminophenyl)-N-methyl-2-[propan-2-yl(propyl)amino]acetamide is sourced from PubChem (CID 43375942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).