N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide

C14H20FNO2 — CID 112697844

IUPACN-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide
SMILESCc1cc(F)ccc1CCNC(=O)COC(C)C
InChIInChI=1S/C14H20FNO2/c1-10(2)18-9-14(17)16-7-6-12-4-5-13(15)8-11(12)3/h4-5,8,10H,6-7,9H2,1-3H3,(H,16,17)
InChIKeyYCPFFXBWTGOTRG-UHFFFAOYSA-N
MW253.32 g/mol
LogP2.22
Rot. Bonds6

About N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide

N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide (PubChem CID 112697844) has the molecular formula C14H20FNO2 and a molecular weight of 253.32 g/mol. Its IUPAC name is N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide.

Molecular Properties

Compound NameN-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide
PubChem CID112697844
Molecular FormulaC14H20FNO2
Molecular Weight253.32 g/mol
Exact Mass253.15
IUPAC NameN-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide
SMILESCc1cc(F)ccc1CCNC(=O)COC(C)C
InChIInChI=1S/C14H20FNO2/c1-10(2)18-9-14(17)16-7-6-12-4-5-13(15)8-11(12)3/h4-5,8,10H,6-7,9H2,1-3H3,(H,16,17)
InChIKeyYCPFFXBWTGOTRG-UHFFFAOYSA-N
XLogP2.22
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.32
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide 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-[2-(4-fluoro-2-methylphenyl)ethyl]-2-(2-methoxyethoxy)acetamide
CID 103747121
4-fluoro-N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-methylbenzamide
CID 115745663
3-amino-N-[2-(4-fluoro-2-methylphenyl)ethyl]-3-phenylpropanamide;hydrochloride
CID 119952335
1-[2-(4-fluoro-2-methylphenyl)ethyl]-3-(2-methylpropyl)thiourea
CID 113254028
(2S)-2-amino-N-[2-(4-fluoro-2-methylphenyl)ethyl]hexanamide
CID 103831842
3-bromo-N-[2-(4-fluoro-2-methylphenyl)ethyl]-4-methylbenzamide
CID 81459566
1-(4-fluoro-2-methylphenyl)-3-propan-2-yloxypropan-2-ol
CID 105131331
2-bromo-N-[2-(2,4-dimethylphenyl)ethyl]acetamide
CID 82109034
2-(4-fluoro-2-methylphenyl)ethylhydrazine
CID 105220815
2-amino-3-[2-(4-fluoro-2-methylphenyl)ethylamino]propanamide
CID 103257000
2-[2-(4-fluoro-2-methylphenyl)ethylcarbamoyl]cyclopentane-1-carboxylic acid
CID 103978975
3-bromo-2-fluoro-N-[2-(4-fluoro-2-methylphenyl)ethyl]benzamide
CID 106544675

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide?
The IUPAC name of N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide (CID 112697844) is N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide.
What is the SMILES notation for N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide?
The canonical SMILES for N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide is Cc1cc(F)ccc1CCNC(=O)COC(C)C.
What is the InChIKey of N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide?
The InChIKey is YCPFFXBWTGOTRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20FNO2/c1-10(2)18-9-14(17)16-7-6-12-4-5-13(15)8-11(12)3/h4-5,8,10H,6-7,9H2,1-3H3,(H,16,17).
What are the key properties of N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide?
N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide has a molecular weight of 253.32 g/mol, XLogP of 2.22, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-fluoro-2-methylphenyl)ethyl]-2-propan-2-yloxyacetamide is sourced from PubChem (CID 112697844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).