N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide

C17H20N2O2 — CID 66417848

IUPACN-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1CNC(C)c1cccc(O)c1
InChIInChI=1S/C17H20N2O2/c1-12(14-7-5-8-16(21)10-14)18-11-15-6-3-4-9-17(15)19-13(2)20/h3-10,12,18,21H,11H2,1-2H3,(H,19,20)
InChIKeyLOUOWSOHMFFYPF-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.20
Rot. Bonds5

About N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide

N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide (PubChem CID 66417848) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide
PubChem CID66417848
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide
SMILESCC(=O)Nc1ccccc1CNC(C)c1cccc(O)c1
InChIInChI=1S/C17H20N2O2/c1-12(14-7-5-8-16(21)10-14)18-11-15-6-3-4-9-17(15)19-13(2)20/h3-10,12,18,21H,11H2,1-2H3,(H,19,20)
InChIKeyLOUOWSOHMFFYPF-UHFFFAOYSA-N
XLogP3.20
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[[[(1R)-1-(3-methylphenyl)ethyl]amino]methyl]phenyl]acetamide
CID 81369235
N-[2-[[1-(4-chlorophenyl)ethylamino]methyl]phenyl]acetamide
CID 66386038
N-[2-[[[(1S)-1-(4-fluorophenyl)ethyl]amino]methyl]phenyl]acetamide
CID 81351725
3-[1-[(2-nitrophenyl)methylamino]ethyl]phenol
CID 43748437
N-[2-[(3-hydroxyanilino)methyl]phenyl]acetamide
CID 66385038
N-[3-[1-[[2-(ethoxymethyl)phenyl]methylamino]ethyl]phenyl]acetamide
CID 119164918
2-[[1-(3-hydroxyphenyl)ethylamino]methyl]-4-methylphenol
CID 63324815
2-[(2-acetamidophenyl)methylamino]-3-methylbutanoic acid
CID 66419829
N-[2-[[1-(1H-1,2,4-triazol-5-yl)ethylamino]methyl]phenyl]acetamide
CID 106282108
3-[1-[(4-chloro-2-fluorophenyl)methylamino]ethyl]phenol
CID 114842006
N-[4-hydroxy-3-[[[(1S)-1-phenylethyl]amino]methyl]phenyl]acetamide
CID 125464014
4-[[1-(3-hydroxyphenyl)ethylamino]methyl]benzamide
CID 43791628

Frequently Asked Questions

What is the IUPAC name of N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide?
The IUPAC name of N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide (CID 66417848) is N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide.
What is the SMILES notation for N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide?
The canonical SMILES for N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide is CC(=O)Nc1ccccc1CNC(C)c1cccc(O)c1.
What is the InChIKey of N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide?
The InChIKey is LOUOWSOHMFFYPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12(14-7-5-8-16(21)10-14)18-11-15-6-3-4-9-17(15)19-13(2)20/h3-10,12,18,21H,11H2,1-2H3,(H,19,20).
What are the key properties of N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide?
N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide has a molecular weight of 284.36 g/mol, XLogP of 3.20, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[1-(3-hydroxyphenyl)ethylamino]methyl]phenyl]acetamide is sourced from PubChem (CID 66417848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).