N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide

C15H14ClFN2O4S — CID 119044636

IUPACN-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide
SMILESCCOc1ccc(C(=O)NS(=O)(=O)Cc2ccc(Cl)c(F)c2)cn1
InChIInChI=1S/C15H14ClFN2O4S/c1-2-23-14-6-4-11(8-18-14)15(20)19-24(21,22)9-10-3-5-12(16)13(17)7-10/h3-8H,2,9H2,1H3,(H,19,20)
InChIKeyRUSAOYQKKNFFHL-UHFFFAOYSA-N
MW372.81 g/mol
LogP2.53
Rot. Bonds6

About N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide

N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide (PubChem CID 119044636) has the molecular formula C15H14ClFN2O4S and a molecular weight of 372.81 g/mol. Its IUPAC name is N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide
PubChem CID119044636
Molecular FormulaC15H14ClFN2O4S
Molecular Weight372.81 g/mol
Exact Mass372.03
IUPAC NameN-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide
SMILESCCOc1ccc(C(=O)NS(=O)(=O)Cc2ccc(Cl)c(F)c2)cn1
InChIInChI=1S/C15H14ClFN2O4S/c1-2-23-14-6-4-11(8-18-14)15(20)19-24(21,22)9-10-3-5-12(16)13(17)7-10/h3-8H,2,9H2,1H3,(H,19,20)
InChIKeyRUSAOYQKKNFFHL-UHFFFAOYSA-N
XLogP2.53
TPSA85.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.81
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide 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-chloro-3-fluorophenyl)methylsulfonyl]-2-(methoxymethyl)-1,3-thiazole-4-carboxamide
CID 119044638
N-(4-ethoxyphenyl)sulfonyl-6-(2,2,2-trifluoroethoxy)pyridine-3-carboxamide
CID 52636494
N-(2-chloro-4-methylphenyl)-6-ethoxypyridine-3-carboxamide
CID 46488346
2-(4-chloro-3-fluorophenyl)-1-(6-chloro-3-pyridinyl)ethanone
CID 114012626
N-tert-butyl-6-ethoxypyridine-3-carboxamide
CID 47244667
N-(5-chloro-1-methylbenzimidazol-2-yl)-6-ethoxypyridine-3-carboxamide
CID 86868002
3-bromo-4-chloro-N-(6-ethoxy-3-pyridinyl)benzamide
CID 107999600
N-(3-bromo-4-ethoxyphenyl)sulfonyl-2-(4-chloro-3-fluorophenyl)acetamide
CID 166333513
6-ethoxy-N-(1H-indol-5-ylmethyl)pyridine-3-carboxamide
CID 68629889
N-[4-(2-amino-2-oxoethyl)phenyl]-6-ethoxypyridine-3-carboxamide
CID 87002406
4-[(4-chloro-3-fluorophenyl)methylsulfonyl]benzoic acid
CID 107881342
N-[2-(2,4-difluorophenyl)-2-hydroxypropyl]-6-ethoxypyridine-3-carboxamide
CID 111335304

Frequently Asked Questions

What is the IUPAC name of N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide?
The IUPAC name of N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide (CID 119044636) is N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide.
What is the SMILES notation for N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide?
The canonical SMILES for N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide is CCOc1ccc(C(=O)NS(=O)(=O)Cc2ccc(Cl)c(F)c2)cn1.
What is the InChIKey of N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide?
The InChIKey is RUSAOYQKKNFFHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFN2O4S/c1-2-23-14-6-4-11(8-18-14)15(20)19-24(21,22)9-10-3-5-12(16)13(17)7-10/h3-8H,2,9H2,1H3,(H,19,20).
What are the key properties of N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide?
N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide has a molecular weight of 372.81 g/mol, XLogP of 2.53, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chloro-3-fluorophenyl)methylsulfonyl]-6-ethoxypyridine-3-carboxamide is sourced from PubChem (CID 119044636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).