2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide

C19H23FN2O3 — CID 111565418

IUPAC2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide
SMILESCc1cccc(C)c1NCC(=O)NCC(O)COc1ccc(F)cc1
InChIInChI=1S/C19H23FN2O3/c1-13-4-3-5-14(2)19(13)22-11-18(24)21-10-16(23)12-25-17-8-6-15(20)7-9-17/h3-9,16,22-23H,10-12H2,1-2H3,(H,21,24)
InChIKeyOWQACEOFLJMTOO-UHFFFAOYSA-N
MW346.40 g/mol
LogP2.41
Rot. Bonds8

About 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide

2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide (PubChem CID 111565418) has the molecular formula C19H23FN2O3 and a molecular weight of 346.40 g/mol. Its IUPAC name is 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide
PubChem CID111565418
Molecular FormulaC19H23FN2O3
Molecular Weight346.40 g/mol
Exact Mass346.17
IUPAC Name2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide
SMILESCc1cccc(C)c1NCC(=O)NCC(O)COc1ccc(F)cc1
InChIInChI=1S/C19H23FN2O3/c1-13-4-3-5-14(2)19(13)22-11-18(24)21-10-16(23)12-25-17-8-6-15(20)7-9-17/h3-9,16,22-23H,10-12H2,1-2H3,(H,21,24)
InChIKeyOWQACEOFLJMTOO-UHFFFAOYSA-N
XLogP2.41
TPSA70.59 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.40
LogP ≤ 52.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]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-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-(2-methylphenyl)acetamide
CID 111110931
4-amino-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]pentanamide
CID 120561361
2-amino-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methylpropanamide
CID 119304994
(Z)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-2-methylbut-2-enamide
CID 111883336
3-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]propanamide
CID 111110980
2-[[3-(4-fluorophenoxy)-2-hydroxypropyl]amino]-N-propan-2-ylacetamide
CID 60909218
2-(2,6-dimethylanilino)-N-[2-(2-methylpropylamino)-2-oxoethyl]acetamide
CID 71998712
3-fluoro-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-5-methylbenzamide
CID 111477313
1-(2,5-dimethylphenyl)-3-[3-(4-fluorophenoxy)-2-hydroxypropyl]urea
CID 110903857
(E)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]-4-(3-fluorophenyl)but-3-enamide
CID 111825354
methyl 2-[[3-(4-fluorophenoxy)-2-hydroxypropyl]amino]acetate
CID 60904479
1-(4-fluorophenoxy)-3-(3-methylanilino)propan-2-ol
CID 60719889

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide?
The IUPAC name of 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide (CID 111565418) is 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide.
What is the SMILES notation for 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide?
The canonical SMILES for 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide is Cc1cccc(C)c1NCC(=O)NCC(O)COc1ccc(F)cc1.
What is the InChIKey of 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide?
The InChIKey is OWQACEOFLJMTOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O3/c1-13-4-3-5-14(2)19(13)22-11-18(24)21-10-16(23)12-25-17-8-6-15(20)7-9-17/h3-9,16,22-23H,10-12H2,1-2H3,(H,21,24).
What are the key properties of 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide?
2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide has a molecular weight of 346.40 g/mol, XLogP of 2.41, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylanilino)-N-[3-(4-fluorophenoxy)-2-hydroxypropyl]acetamide is sourced from PubChem (CID 111565418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).