N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide

C14H21NO2 — CID 61399862

IUPACN-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide
SMILESCCN(CC(C)C)C(=O)Cc1cccc(O)c1
InChIInChI=1S/C14H21NO2/c1-4-15(10-11(2)3)14(17)9-12-6-5-7-13(16)8-12/h5-8,11,16H,4,9-10H2,1-3H3
InChIKeyJUXNRKTUPWMWOO-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.44
Rot. Bonds5

About N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide

N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide (PubChem CID 61399862) has the molecular formula C14H21NO2 and a molecular weight of 235.33 g/mol. Its IUPAC name is N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide.

Molecular Properties

Compound NameN-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide
PubChem CID61399862
Molecular FormulaC14H21NO2
Molecular Weight235.33 g/mol
Exact Mass235.16
IUPAC NameN-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide
SMILESCCN(CC(C)C)C(=O)Cc1cccc(O)c1
InChIInChI=1S/C14H21NO2/c1-4-15(10-11(2)3)14(17)9-12-6-5-7-13(16)8-12/h5-8,11,16H,4,9-10H2,1-3H3
InChIKeyJUXNRKTUPWMWOO-UHFFFAOYSA-N
XLogP2.44
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-hydroxyphenyl)-N-(2-methylpropyl)-N-propan-2-ylacetamide
CID 55000494
N-butyl-N-ethyl-2-(3-hydroxyphenyl)acetamide
CID 61399892
ethyl 2-[ethyl-[2-(3-hydroxyphenyl)acetyl]amino]acetate
CID 54984127
N-ethyl-N,2-bis(3-hydroxyphenyl)acetamide
CID 107735678
2-(4-aminophenyl)-N-ethyl-N-(2-methylpropyl)acetamide;hydrochloride
CID 119732292
N-(4-aminobutan-2-yl)-2-(3-hydroxyphenyl)-N-methylacetamide
CID 55173941
N-ethyl-2-(3-hydroxyphenyl)-N-(oxolan-2-ylmethyl)acetamide
CID 61435069
N-(3-amino-2-methyl-3-sulfanylidenepropyl)-N-ethyl-2-(3-methylphenyl)acetamide
CID 55067661
2-(3-hydroxyphenyl)-N-methyl-N-[(4-methylphenyl)methyl]acetamide
CID 61399859
N-ethoxy-2-(3-hydroxyphenyl)acetamide
CID 62039263
N-[(3Z)-3-amino-3-hydroxyimino-2-methylpropyl]-2-(3-hydroxyphenyl)-N-methylacetamide
CID 54991694
benzyl N-ethyl-N-(2-methylpropyl)carbamate
CID 130580876

Frequently Asked Questions

What is the IUPAC name of N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide?
The IUPAC name of N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide (CID 61399862) is N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide.
What is the SMILES notation for N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide?
The canonical SMILES for N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide is CCN(CC(C)C)C(=O)Cc1cccc(O)c1.
What is the InChIKey of N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide?
The InChIKey is JUXNRKTUPWMWOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21NO2/c1-4-15(10-11(2)3)14(17)9-12-6-5-7-13(16)8-12/h5-8,11,16H,4,9-10H2,1-3H3.
What are the key properties of N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide?
N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide has a molecular weight of 235.33 g/mol, XLogP of 2.44, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-2-(3-hydroxyphenyl)-N-(2-methylpropyl)acetamide is sourced from PubChem (CID 61399862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).