N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide

C15H24N2O3 — CID 63931523

IUPACN-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide
SMILESCCOCC(O)CNC(C)c1cccc(NC(C)=O)c1
InChIInChI=1S/C15H24N2O3/c1-4-20-10-15(19)9-16-11(2)13-6-5-7-14(8-13)17-12(3)18/h5-8,11,15-16,19H,4,9-10H2,1-3H3,(H,17,18)
InChIKeyAOSDIJIOEQNKLU-UHFFFAOYSA-N
MW280.37 g/mol
LogP1.69
Rot. Bonds8

About N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide

N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide (PubChem CID 63931523) has the molecular formula C15H24N2O3 and a molecular weight of 280.37 g/mol. Its IUPAC name is N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide
PubChem CID63931523
Molecular FormulaC15H24N2O3
Molecular Weight280.37 g/mol
Exact Mass280.18
IUPAC NameN-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide
SMILESCCOCC(O)CNC(C)c1cccc(NC(C)=O)c1
InChIInChI=1S/C15H24N2O3/c1-4-20-10-15(19)9-16-11(2)13-6-5-7-14(8-13)17-12(3)18/h5-8,11,15-16,19H,4,9-10H2,1-3H3,(H,17,18)
InChIKeyAOSDIJIOEQNKLU-UHFFFAOYSA-N
XLogP1.69
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 51.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[1-(2-hydroxybutylamino)ethyl]phenyl]acetamide
CID 54880370
N-[3-[1-[(2-hydroxy-4-methylpentyl)amino]ethyl]phenyl]acetamide
CID 103779662
N-[3-[1-(3-ethoxypropylamino)ethyl]phenyl]acetamide
CID 43201568
1-ethoxy-3-[[(1R)-1-phenylethyl]amino]propan-2-ol
CID 78954638
N-[3-[(1R)-1-[[(2R)-2-hydroxy-3-(2-methylpropoxy)propyl]carbamoylamino]ethyl]phenyl]acetamide
CID 94060411
N-[3-[1-[[2-(ethoxymethyl)phenyl]methylamino]ethyl]phenyl]acetamide
CID 119164918
N-[3-[1-(3-propoxypropylamino)ethyl]phenyl]acetamide
CID 82940339
N-[3-[1-[2-(2-methylpropoxy)ethylamino]ethyl]phenyl]acetamide
CID 115713617
1-[1-(3-bromophenyl)ethylamino]-3-(2-ethoxyethoxy)propan-2-ol
CID 60746287
N-[3-[1-[(4-hydroxy-2-phenylpentyl)amino]ethyl]phenyl]acetamide
CID 86779553
N-[3-[1-(but-2-ynylamino)ethyl]phenyl]acetamide
CID 62309945
N-[3-[1-[[2-hydroxy-3-(thiophen-2-ylmethoxy)propyl]amino]ethyl]phenyl]benzamide
CID 112840104

Frequently Asked Questions

What is the IUPAC name of N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide?
The IUPAC name of N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide (CID 63931523) is N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide.
What is the SMILES notation for N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide?
The canonical SMILES for N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide is CCOCC(O)CNC(C)c1cccc(NC(C)=O)c1.
What is the InChIKey of N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide?
The InChIKey is AOSDIJIOEQNKLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O3/c1-4-20-10-15(19)9-16-11(2)13-6-5-7-14(8-13)17-12(3)18/h5-8,11,15-16,19H,4,9-10H2,1-3H3,(H,17,18).
What are the key properties of N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide?
N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide has a molecular weight of 280.37 g/mol, XLogP of 1.69, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[1-[(3-ethoxy-2-hydroxypropyl)amino]ethyl]phenyl]acetamide is sourced from PubChem (CID 63931523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).