N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide

C16H18N2O3 — CID 43717389

IUPACN-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(NCc2ccc(O)cc2)cc1
InChIInChI=1S/C16H18N2O3/c1-21-11-16(20)18-14-6-4-13(5-7-14)17-10-12-2-8-15(19)9-3-12/h2-9,17,19H,10-11H2,1H3,(H,18,20)
InChIKeyBDDLSABNAQJOCZ-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.59
Rot. Bonds6

About N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide

N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide (PubChem CID 43717389) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide
PubChem CID43717389
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC NameN-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(NCc2ccc(O)cc2)cc1
InChIInChI=1S/C16H18N2O3/c1-21-11-16(20)18-14-6-4-13(5-7-14)17-10-12-2-8-15(19)9-3-12/h2-9,17,19H,10-11H2,1H3,(H,18,20)
InChIKeyBDDLSABNAQJOCZ-UHFFFAOYSA-N
XLogP2.59
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.59
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-methoxy-N-[4-(pyrimidin-5-ylmethylamino)phenyl]acetamide
CID 62760279
N-[4-(hydroxymethyl)phenyl]-2-methoxyacetamide
CID 64794296
2-methoxy-N-[4-[[4-(methoxymethyl)phenyl]methylcarbamoylamino]phenyl]acetamide
CID 55697500
2-[4-[(4-hydroxyanilino)methyl]-2-methoxyphenoxy]-N-(4-methylphenyl)acetamide
CID 66525784
N-[(4-acetamidophenyl)methyl]-2-methoxyacetamide
CID 29327648
N-[4-[(5-ethylthiophen-2-yl)methylamino]phenyl]-2-methoxyacetamide
CID 62345367
N-[4-[(2-chlorophenyl)methylamino]phenyl]-2-methoxyacetamide
CID 43717390
2-amino-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 43708154
N-(4-hydrazinylphenyl)-2-methoxyacetamide
CID 141361616
2-(4-methylphenoxy)-N-[4-[(4-methylphenyl)methylamino]phenyl]acetamide
CID 112982175
N-[4-[(4-methoxyphenyl)methylamino]phenyl]-2-phenoxyacetamide
CID 112982725
2-methoxy-N-[4-[(2-methylpyrazol-3-yl)methylamino]phenyl]acetamide
CID 43717460

Frequently Asked Questions

What is the IUPAC name of N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide?
The IUPAC name of N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide (CID 43717389) is N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide.
What is the SMILES notation for N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide?
The canonical SMILES for N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide is COCC(=O)Nc1ccc(NCc2ccc(O)cc2)cc1.
What is the InChIKey of N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide?
The InChIKey is BDDLSABNAQJOCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-21-11-16(20)18-14-6-4-13(5-7-14)17-10-12-2-8-15(19)9-3-12/h2-9,17,19H,10-11H2,1H3,(H,18,20).
What are the key properties of N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide?
N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide has a molecular weight of 286.33 g/mol, XLogP of 2.59, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(4-hydroxyphenyl)methylamino]phenyl]-2-methoxyacetamide is sourced from PubChem (CID 43717389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).