2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide

C16H26N2O2 — CID 80556703

IUPAC2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide
SMILESCCOCCN(CC)C(=O)C(C)(C)c1ccc(N)cc1
InChIInChI=1S/C16H26N2O2/c1-5-18(11-12-20-6-2)15(19)16(3,4)13-7-9-14(17)10-8-13/h7-10H,5-6,11-12,17H2,1-4H3
InChIKeyGBGSKSLPAHWAMM-UHFFFAOYSA-N
MW278.40 g/mol
LogP2.43
Rot. Bonds7

About 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide

2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide (PubChem CID 80556703) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide
PubChem CID80556703
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide
SMILESCCOCCN(CC)C(=O)C(C)(C)c1ccc(N)cc1
InChIInChI=1S/C16H26N2O2/c1-5-18(11-12-20-6-2)15(19)16(3,4)13-7-9-14(17)10-8-13/h7-10H,5-6,11-12,17H2,1-4H3
InChIKeyGBGSKSLPAHWAMM-UHFFFAOYSA-N
XLogP2.43
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 52.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-(4-aminophenoxy)-N-(2-ethoxyethyl)-N-ethylacetamide
CID 63696448
2-(4-aminophenyl)-N,N,2-trimethylpropanamide
CID 80556055
N-(2-ethoxyethyl)-N-ethyl-2-methyl-2-(methylamino)propanamide
CID 63690570
2-(4-aminophenyl)-N-(2-hydroxyethyl)-N,2-dimethylpropanamide
CID 80503099
N,N-bis(2-ethoxyethyl)-2,2-dimethylpropanamide
CID 82952265
2-(4-aminophenyl)-N-cyclopropyl-2-methyl-N-propylpropanamide
CID 80556057
5-amino-N,N-bis(2-ethoxyethyl)-2-methylbenzamide
CID 82959703
2-propoxyethyl 2-(4-aminophenyl)-2-methylpropanoate
CID 80555976
2-amino-N-(2-ethoxyethyl)-N-ethyl-4-fluorobenzamide
CID 55228471
5-amino-N,N-bis(2-ethoxyethyl)pyridine-2-carboxamide
CID 82965848
N-(2-ethoxyethyl)-N-ethylbenzamide
CID 63718241
6-amino-N-(2-ethoxyethyl)-N-ethylpyridine-2-carboxamide
CID 63691666

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide?
The IUPAC name of 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide (CID 80556703) is 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide?
The canonical SMILES for 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide is CCOCCN(CC)C(=O)C(C)(C)c1ccc(N)cc1.
What is the InChIKey of 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide?
The InChIKey is GBGSKSLPAHWAMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-5-18(11-12-20-6-2)15(19)16(3,4)13-7-9-14(17)10-8-13/h7-10H,5-6,11-12,17H2,1-4H3.
What are the key properties of 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide?
2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide has a molecular weight of 278.40 g/mol, XLogP of 2.43, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(2-ethoxyethyl)-N-ethyl-2-methylpropanamide is sourced from PubChem (CID 80556703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).