N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide

C16H17NO3 — CID 47292082

IUPACN-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)NCc2cccc(O)c2)c1
InChIInChI=1S/C16H17NO3/c1-20-15-7-3-4-12(9-15)10-16(19)17-11-13-5-2-6-14(18)8-13/h2-9,18H,10-11H2,1H3,(H,17,19)
InChIKeyLBFRAATXXUXLAJ-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.26
Rot. Bonds5

About N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide

N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide (PubChem CID 47292082) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
PubChem CID47292082
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)NCc2cccc(O)c2)c1
InChIInChI=1S/C16H17NO3/c1-20-15-7-3-4-12(9-15)10-16(19)17-11-13-5-2-6-14(18)8-13/h2-9,18H,10-11H2,1H3,(H,17,19)
InChIKeyLBFRAATXXUXLAJ-UHFFFAOYSA-N
XLogP2.26
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-hydroxyphenyl)methyl]-3-methoxybenzamide
CID 47292174
N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 115598846
N-[(3-methoxyphenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2086540
1-[2-(3-hydroxyphenyl)ethyl]-3-[(3-methoxyphenyl)methyl]urea
CID 60602886
2-chloro-N-[(3-methoxyphenyl)methyl]acetamide
CID 4839545
2-hydroxy-N-[(3-hydroxyphenyl)methyl]-4-methoxybenzamide
CID 47292166
2-cyano-N-[(3-methoxyphenyl)methyl]acetamide
CID 55134556
N-(3-hydroxyphenyl)-2-(3-methoxyphenyl)acetamide
CID 28739724
N-hydroxy-4-[[[2-(3-methoxyphenyl)acetyl]amino]methyl]benzamide
CID 90480233
N-[(3-methoxyphenyl)methyl]-2-(5-methyl-1H-pyrrol-3-yl)acetamide
CID 112522336
2-(3-methoxyphenyl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide
CID 18116287
N-[(3-hydroxyphenyl)methyl]-2,4-dimethoxybenzamide
CID 61018179

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
The IUPAC name of N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide (CID 47292082) is N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide is COc1cccc(CC(=O)NCc2cccc(O)c2)c1.
What is the InChIKey of N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
The InChIKey is LBFRAATXXUXLAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-20-15-7-3-4-12(9-15)10-16(19)17-11-13-5-2-6-14(18)8-13/h2-9,18H,10-11H2,1H3,(H,17,19).
What are the key properties of N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide has a molecular weight of 271.32 g/mol, XLogP of 2.26, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 47292082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).