N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide

C15H24N2O3 — CID 82364486

IUPACN,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide
SMILESCCN(CC)C(=O)COc1ccc(CNCCO)cc1
InChIInChI=1S/C15H24N2O3/c1-3-17(4-2)15(19)12-20-14-7-5-13(6-8-14)11-16-9-10-18/h5-8,16,18H,3-4,9-12H2,1-2H3
InChIKeyNNOYQZIBIVKZNY-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.02
Rot. Bonds9

About N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide

N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide (PubChem CID 82364486) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide
PubChem CID82364486
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide
SMILESCCN(CC)C(=O)COc1ccc(CNCCO)cc1
InChIInChI=1S/C15H24N2O3/c1-3-17(4-2)15(19)12-20-14-7-5-13(6-8-14)11-16-9-10-18/h5-8,16,18H,3-4,9-12H2,1-2H3
InChIKeyNNOYQZIBIVKZNY-UHFFFAOYSA-N
XLogP1.02
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N,N-diethyl-2-[4-(ethylaminomethyl)phenoxy]acetamide
CID 43276989
N,N-diethyl-2-[4-(2-oxoethyl)phenoxy]acetamide
CID 82362951
N,N-diethyl-2-[4-(methylamino)phenoxy]acetamide
CID 54908693
2-[4-[[3-(diethylamino)propylamino]methyl]phenoxy]acetic acid
CID 17215297
N,N-diethyl-2-(4-sulfanylphenoxy)acetamide
CID 23092623
3-[(4-ethoxyphenyl)methyl]-1-ethyl-1-(2-hydroxyethyl)urea
CID 108884453
N-tert-butyl-2-[4-[[2-(2-hydroxyethylamino)ethylamino]methyl]phenoxy]acetamide;dihydrochloride
CID 17295535
3-[(4-ethoxyphenyl)methylamino]propan-1-ol
CID 7991761
2-[(4-methoxyphenyl)methylamino]ethanol;hydrochloride
CID 17292349
N,N-diethyl-2-[4-(propylsulfamoyl)phenoxy]acetamide
CID 45375378
acetic acid;2-[[4-[(4-chlorophenyl)methoxy]phenyl]methylamino]ethanol
CID 45100113
2-[4-(propylaminomethyl)phenoxy]ethanol
CID 17213252

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide?
The IUPAC name of N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide (CID 82364486) is N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide.
What is the SMILES notation for N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide?
The canonical SMILES for N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide is CCN(CC)C(=O)COc1ccc(CNCCO)cc1.
What is the InChIKey of N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide?
The InChIKey is NNOYQZIBIVKZNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-3-17(4-2)15(19)12-20-14-7-5-13(6-8-14)11-16-9-10-18/h5-8,16,18H,3-4,9-12H2,1-2H3.
What are the key properties of N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide?
N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide has a molecular weight of 280.37 g/mol, XLogP of 1.02, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[4-[(2-hydroxyethylamino)methyl]phenoxy]acetamide is sourced from PubChem (CID 82364486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).