N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide

C15H15FN2O3S — CID 53499045

IUPACN-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide
SMILESCN(Cc1ccc(F)cc1)C(=O)CS(=O)(=O)c1ccccn1
InChIInChI=1S/C15H15FN2O3S/c1-18(10-12-5-7-13(16)8-6-12)15(19)11-22(20,21)14-4-2-3-9-17-14/h2-9H,10-11H2,1H3
InChIKeyPSSCGGCAPRHXPD-UHFFFAOYSA-N
MW322.36 g/mol
LogP1.65
Rot. Bonds5

About N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide

N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide (PubChem CID 53499045) has the molecular formula C15H15FN2O3S and a molecular weight of 322.36 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide
PubChem CID53499045
Molecular FormulaC15H15FN2O3S
Molecular Weight322.36 g/mol
Exact Mass322.08
IUPAC NameN-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide
SMILESCN(Cc1ccc(F)cc1)C(=O)CS(=O)(=O)c1ccccn1
InChIInChI=1S/C15H15FN2O3S/c1-18(10-12-5-7-13(16)8-6-12)15(19)11-22(20,21)14-4-2-3-9-17-14/h2-9H,10-11H2,1H3
InChIKeyPSSCGGCAPRHXPD-UHFFFAOYSA-N
XLogP1.65
TPSA67.34 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide 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

2-[(4-fluorophenyl)methylsulfonyl]pyridine
CID 22764648
N-[(4-fluorophenyl)methyl]-N-methyl-2-[4-(pyridin-2-ylmethyl)piperazin-1-yl]acetamide
CID 134055413
3-amino-N-[(4-fluorophenyl)methyl]-N-methylpropanamide
CID 39242618
2-(benzenesulfonyl)-N-[(4-methoxyphenyl)methyl]-N-methylacetamide
CID 112779738
2-(2-fluorophenyl)-N-[(4-fluorophenyl)methyl]-N-methylacetamide
CID 78771203
N-benzyl-2-(4-fluorophenyl)-N-methyl-2-pyridin-2-ylacetamide
CID 110373544
N-[(4-fluorophenyl)methyl]-N-methyl-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112604549
N-[(4-fluorophenyl)methyl]-N-methyl-4-phenoxybutanamide
CID 78770382
N-[(4-fluorophenyl)methyl]-2-[3-[(4-fluorophenyl)methylsulfonyl]indol-1-yl]-N-methylacetamide
CID 70169296
N-[(4-chlorophenyl)methyl]-2-(4-chlorophenyl)sulfonyl-N-methylacetamide
CID 31988550
N-[(4-fluorophenyl)methyl]-N-methyl-3-(5-phenyl-1,3-oxazol-2-yl)propanamide
CID 51075029
2-[2-[benzyl(methyl)amino]-2-oxoethyl]sulfonylacetic acid
CID 82180460

Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide (CID 53499045) is N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide is CN(Cc1ccc(F)cc1)C(=O)CS(=O)(=O)c1ccccn1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide?
The InChIKey is PSSCGGCAPRHXPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3S/c1-18(10-12-5-7-13(16)8-6-12)15(19)11-22(20,21)14-4-2-3-9-17-14/h2-9H,10-11H2,1H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide?
N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide has a molecular weight of 322.36 g/mol, XLogP of 1.65, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-N-methyl-2-pyridin-2-ylsulfonylacetamide is sourced from PubChem (CID 53499045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).