N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide

C12H16FNO2 — CID 60706405

IUPACN-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide
SMILESCCN(CCO)C(=O)c1cc(F)ccc1C
InChIInChI=1S/C12H16FNO2/c1-3-14(6-7-15)12(16)11-8-10(13)5-4-9(11)2/h4-5,8,15H,3,6-7H2,1-2H3
InChIKeyDCHZVYRLAWIECO-UHFFFAOYSA-N
MW225.26 g/mol
LogP1.59
Rot. Bonds4

About N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide

N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide (PubChem CID 60706405) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide.

Molecular Properties

Compound NameN-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide
PubChem CID60706405
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC NameN-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide
SMILESCCN(CCO)C(=O)c1cc(F)ccc1C
InChIInChI=1S/C12H16FNO2/c1-3-14(6-7-15)12(16)11-8-10(13)5-4-9(11)2/h4-5,8,15H,3,6-7H2,1-2H3
InChIKeyDCHZVYRLAWIECO-UHFFFAOYSA-N
XLogP1.59
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide 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-ethyl-5-fluoro-N-(3-hydroxypropyl)-2-methylbenzamide
CID 113339465
N-ethyl-2,4-difluoro-N-(2-hydroxyethyl)benzamide
CID 60653825
N-(2-cyanoethyl)-N-ethyl-5-fluoro-2-methylbenzamide
CID 63047743
5-fluoro-N-(2-hydroxyethyl)-N,2-dimethylbenzamide
CID 60706402
N-(cyanomethyl)-N-ethyl-5-fluoro-2-methylbenzamide
CID 62611797
N-ethyl-5-fluoro-2-methyl-N-prop-2-ynylbenzamide
CID 78971177
N-(2-amino-2-sulfanylideneethyl)-N-ethyl-5-fluoro-2-methylbenzamide
CID 63049826
ethyl 2-[ethyl-(5-fluoro-2-methylbenzoyl)amino]acetate
CID 61073584
5-fluoro-N-(2-hydroxyethyl)-2-methyl-N-pentan-3-ylbenzamide
CID 63049149
N-ethyl-7-fluoro-N-(2-hydroxyethyl)-2-methylquinoline-4-carboxamide
CID 78860252
2-(difluoromethoxy)-N-ethyl-4-fluoro-N-(2-hydroxyethyl)benzamide
CID 109468392
3-amino-N-ethyl-2,5-difluoro-N-(2-hydroxyethyl)benzamide
CID 107120608

Frequently Asked Questions

What is the IUPAC name of N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide?
The IUPAC name of N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide (CID 60706405) is N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide.
What is the SMILES notation for N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide?
The canonical SMILES for N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide is CCN(CCO)C(=O)c1cc(F)ccc1C.
What is the InChIKey of N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide?
The InChIKey is DCHZVYRLAWIECO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c1-3-14(6-7-15)12(16)11-8-10(13)5-4-9(11)2/h4-5,8,15H,3,6-7H2,1-2H3.
What are the key properties of N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide?
N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide has a molecular weight of 225.26 g/mol, XLogP of 1.59, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-5-fluoro-N-(2-hydroxyethyl)-2-methylbenzamide is sourced from PubChem (CID 60706405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).