N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide

C16H23NO3 — CID 102684250

IUPACN-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide
SMILESCc1ccc(OCC(=O)N(CCO)C2CCC2)c(C)c1
InChIInChI=1S/C16H23NO3/c1-12-6-7-15(13(2)10-12)20-11-16(19)17(8-9-18)14-4-3-5-14/h6-7,10,14,18H,3-5,8-9,11H2,1-2H3
InChIKeyFLQVOKUEDQFHAQ-UHFFFAOYSA-N
MW277.36 g/mol
LogP2.06
Rot. Bonds6

About N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide

N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide (PubChem CID 102684250) has the molecular formula C16H23NO3 and a molecular weight of 277.36 g/mol. Its IUPAC name is N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide.

Molecular Properties

Compound NameN-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide
PubChem CID102684250
Molecular FormulaC16H23NO3
Molecular Weight277.36 g/mol
Exact Mass277.17
IUPAC NameN-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide
SMILESCc1ccc(OCC(=O)N(CCO)C2CCC2)c(C)c1
InChIInChI=1S/C16H23NO3/c1-12-6-7-15(13(2)10-12)20-11-16(19)17(8-9-18)14-4-3-5-14/h6-7,10,14,18H,3-5,8-9,11H2,1-2H3
InChIKeyFLQVOKUEDQFHAQ-UHFFFAOYSA-N
XLogP2.06
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.36
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-cyclopropyl-N-(2-hydroxyethyl)-2-(2,4,6-trimethylphenoxy)acetamide
CID 43576640
N-cyclobutyl-2-(2,6-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide
CID 102684292
N-cyclopropyl-2-(2,4-difluorophenoxy)-N-(2-hydroxyethyl)acetamide
CID 43577200
N-cyclobutyl-N-(2-hydroxyethyl)-2-phenoxyacetamide
CID 102684381
2-(2,4-dimethylphenoxy)-N-[(3S)-1,1-dioxothiolan-3-yl]-N-(2-methylpropyl)acetamide
CID 7260038
2-(2-amino-4-methylphenoxy)-N-cyclopropyl-N-ethylacetamide
CID 54957478
2-(2-carbamothioylphenoxy)-N-cyclobutyl-N-(2-hydroxyethyl)acetamide
CID 102862530
N-cyclobutyl-2-(2,4-difluorophenoxy)-N-(3-hydroxypropyl)acetamide
CID 102866483
2-(2,4-dimethylphenoxy)-N-methylacetamide
CID 965410
N-cyclopropyl-2-(2,5-dimethylphenyl)sulfanyl-N-(2-hydroxyethyl)acetamide
CID 43577384
3-(2,4-dimethylphenoxy)-N-piperidin-4-yl-N-propylpropanamide;hydrochloride
CID 119824893
2-(4-chloro-2-methylphenoxy)-N-piperidin-4-yl-N-propylacetamide;hydrochloride
CID 119823009

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide?
The IUPAC name of N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide (CID 102684250) is N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide.
What is the SMILES notation for N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide?
The canonical SMILES for N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide is Cc1ccc(OCC(=O)N(CCO)C2CCC2)c(C)c1.
What is the InChIKey of N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide?
The InChIKey is FLQVOKUEDQFHAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23NO3/c1-12-6-7-15(13(2)10-12)20-11-16(19)17(8-9-18)14-4-3-5-14/h6-7,10,14,18H,3-5,8-9,11H2,1-2H3.
What are the key properties of N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide?
N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide has a molecular weight of 277.36 g/mol, XLogP of 2.06, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-2-(2,4-dimethylphenoxy)-N-(2-hydroxyethyl)acetamide is sourced from PubChem (CID 102684250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).