2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide

C16H16FNO2 — CID 62510659

IUPAC2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide
SMILESCc1ccc(F)c(C(=O)Nc2ccc(C(C)O)cc2)c1
InChIInChI=1S/C16H16FNO2/c1-10-3-8-15(17)14(9-10)16(20)18-13-6-4-12(5-7-13)11(2)19/h3-9,11,19H,1-2H3,(H,18,20)
InChIKeyMNEMCYUCMJFQHK-UHFFFAOYSA-N
MW273.31 g/mol
LogP3.44
Rot. Bonds3

About 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide

2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide (PubChem CID 62510659) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide.

Molecular Properties

Compound Name2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide
PubChem CID62510659
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide
SMILESCc1ccc(F)c(C(=O)Nc2ccc(C(C)O)cc2)c1
InChIInChI=1S/C16H16FNO2/c1-10-3-8-15(17)14(9-10)16(20)18-13-6-4-12(5-7-13)11(2)19/h3-9,11,19H,1-2H3,(H,18,20)
InChIKeyMNEMCYUCMJFQHK-UHFFFAOYSA-N
XLogP3.44
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-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-[4-(1-hydroxyethyl)phenyl]-2,5-dimethylbenzamide
CID 43416665
2-hydroxy-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide
CID 43508388
2-fluoro-N-(4-fluorophenyl)-5-methylbenzamide
CID 62509352
1-(2-fluoro-5-methylphenyl)-3-[4-(1-hydroxyethyl)phenyl]urea
CID 61346848
2-fluoro-N-[4-fluoro-3-(trifluoromethyl)phenyl]-5-methylbenzamide
CID 60615705
2-fluoro-N-(3-fluoro-4-hydroxyphenyl)-5-methylbenzamide
CID 64780308
N-(3-chloro-4-fluorophenyl)-2-fluoro-5-methylbenzamide
CID 62510400
2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-3-methylbenzamide
CID 81477970
2,4,6-trifluoro-N-[4-(1-hydroxyethyl)phenyl]benzamide
CID 65100671
N-[4-(cyanomethyl)phenyl]-2-fluoro-5-methylbenzamide
CID 62515692
N-[4-[(1S)-1-hydroxyethyl]phenyl]-3-methylbenzamide
CID 93040828
N-(3-amino-4-bromophenyl)-2-fluoro-5-methylbenzamide
CID 79767809

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide?
The IUPAC name of 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide (CID 62510659) is 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide.
What is the SMILES notation for 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide?
The canonical SMILES for 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide is Cc1ccc(F)c(C(=O)Nc2ccc(C(C)O)cc2)c1.
What is the InChIKey of 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide?
The InChIKey is MNEMCYUCMJFQHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-10-3-8-15(17)14(9-10)16(20)18-13-6-4-12(5-7-13)11(2)19/h3-9,11,19H,1-2H3,(H,18,20).
What are the key properties of 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide?
2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide has a molecular weight of 273.31 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[4-(1-hydroxyethyl)phenyl]-5-methylbenzamide is sourced from PubChem (CID 62510659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).