2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide

C17H19NO3 — CID 62727102

IUPAC2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(C(C)NC(=O)Cc2cccc(O)c2)cc1
InChIInChI=1S/C17H19NO3/c1-12(14-6-8-16(21-2)9-7-14)18-17(20)11-13-4-3-5-15(19)10-13/h3-10,12,19H,11H2,1-2H3,(H,18,20)
InChIKeyITMUYQYKQONBTN-UHFFFAOYSA-N
MW285.34 g/mol
LogP2.82
Rot. Bonds5

About 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide

2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide (PubChem CID 62727102) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide.

Molecular Properties

Compound Name2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
PubChem CID62727102
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Name2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
SMILESCOc1ccc(C(C)NC(=O)Cc2cccc(O)c2)cc1
InChIInChI=1S/C17H19NO3/c1-12(14-6-8-16(21-2)9-7-14)18-17(20)11-13-4-3-5-15(19)10-13/h3-10,12,19H,11H2,1-2H3,(H,18,20)
InChIKeyITMUYQYKQONBTN-UHFFFAOYSA-N
XLogP2.82
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 94843836
2-(3-methoxyphenyl)-N-[1-[4-(2-methylpropyl)phenyl]ethyl]acetamide
CID 42997257
3-[1-(4-methoxyphenyl)ethylamino]phenol
CID 43206982
2-(4-methoxyphenyl)-N-[(1S)-1-naphthalen-2-ylethyl]acetamide
CID 974464
2-(4-methoxyphenyl)-N-[1-(4-propan-2-yloxyphenyl)ethyl]acetamide
CID 134060669
N-[(1R)-1-(4-fluorophenyl)ethyl]-2-(4-methoxyphenyl)acetamide
CID 2713156
2-bromo-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81370298
2-amino-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 81364080
2-(2-methoxyphenyl)-N-[(1R)-1-(4-methoxyphenyl)ethyl]acetamide
CID 40636202
2-(4-acetamidophenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide
CID 108792620
3-[1-[[(1R)-1-(4-methoxyphenyl)ethyl]amino]ethyl]phenol
CID 81370710
3-[1-[1-(4-methoxyphenyl)ethylamino]ethyl]phenol
CID 43748561

Frequently Asked Questions

What is the IUPAC name of 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
The IUPAC name of 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide (CID 62727102) is 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide.
What is the SMILES notation for 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
The canonical SMILES for 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide is COc1ccc(C(C)NC(=O)Cc2cccc(O)c2)cc1.
What is the InChIKey of 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
The InChIKey is ITMUYQYKQONBTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-12(14-6-8-16(21-2)9-7-14)18-17(20)11-13-4-3-5-15(19)10-13/h3-10,12,19H,11H2,1-2H3,(H,18,20).
What are the key properties of 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide?
2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide has a molecular weight of 285.34 g/mol, XLogP of 2.82, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-hydroxyphenyl)-N-[1-(4-methoxyphenyl)ethyl]acetamide is sourced from PubChem (CID 62727102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).