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

C16H17NO3 — CID 115598846

IUPACN-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)NCc2ccccc2O)c1
InChIInChI=1S/C16H17NO3/c1-20-14-7-4-5-12(9-14)10-16(19)17-11-13-6-2-3-8-15(13)18/h2-9,18H,10-11H2,1H3,(H,17,19)
InChIKeySSKZNFMVHIGEEH-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.26
Rot. Bonds5

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

N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide (PubChem CID 115598846) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
PubChem CID115598846
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC NameN-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
SMILESCOc1cccc(CC(=O)NCc2ccccc2O)c1
InChIInChI=1S/C16H17NO3/c1-20-14-7-4-5-12(9-14)10-16(19)17-11-13-6-2-3-8-15(13)18/h2-9,18H,10-11H2,1H3,(H,17,19)
InChIKeySSKZNFMVHIGEEH-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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Related Compounds

N-[(3-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide
CID 47292082
N-[(3-methoxyphenyl)methyl]-2-naphthalen-1-ylacetamide
CID 2086540
2-(3-methoxyphenyl)-N-[(2-nitrophenyl)methyl]acetamide
CID 87004950
2-(3-methoxyphenyl)-N-[(2,4,5-trimethoxyphenyl)methyl]acetamide
CID 18116287
2-(2-hydroxyphenyl)-N-[(2S)-1-(3-methoxyphenyl)propan-2-yl]acetamide
CID 96532447
2-(2-hydroxyphenyl)-N-[(4-methoxyphenyl)methyl]acetamide
CID 2544461
N-hydroxy-4-[[[2-(3-methoxyphenyl)acetyl]amino]methyl]benzamide
CID 90480233
2-(3-methoxyphenyl)-N-[(5-oxo-1,2-dihydropyrazol-3-yl)methyl]acetamide
CID 112536479
2-[[2-[[2-(3-methoxyphenyl)acetyl]amino]acetyl]amino]acetic acid
CID 43387533
N-[2-(4-hydroxyphenyl)ethyl]-2-(3-methoxyphenyl)acetamide
CID 61017914
2-(3-methoxyphenyl)-N-(1,3-thiazol-4-ylmethyl)acetamide
CID 49345906
2-(3-methoxyphenyl)-N-phenylacetamide
CID 2598681

Frequently Asked Questions

What is the IUPAC name of N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
The IUPAC name of N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide (CID 115598846) is N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide is COc1cccc(CC(=O)NCc2ccccc2O)c1.
What is the InChIKey of N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
The InChIKey is SSKZNFMVHIGEEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-20-14-7-4-5-12(9-14)10-16(19)17-11-13-6-2-3-8-15(13)18/h2-9,18H,10-11H2,1H3,(H,17,19).
What are the key properties of N-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide?
N-[(2-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-[(2-hydroxyphenyl)methyl]-2-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 115598846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).