2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide

C15H17N3O4S — CID 84580650

IUPAC2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide
SMILESCOc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)ccn1
InChIInChI=1S/C15H17N3O4S/c1-22-14-10-12(7-9-17-14)15(19)18-8-6-11-2-4-13(5-3-11)23(16,20)21/h2-5,7,9-10H,6,8H2,1H3,(H,18,19)(H2,16,20,21)
InChIKeyRJHQLHTZJITDSP-UHFFFAOYSA-N
MW335.39 g/mol
LogP0.71
Rot. Bonds6

About 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide

2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide (PubChem CID 84580650) has the molecular formula C15H17N3O4S and a molecular weight of 335.39 g/mol. Its IUPAC name is 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide
PubChem CID84580650
Molecular FormulaC15H17N3O4S
Molecular Weight335.39 g/mol
Exact Mass335.09
IUPAC Name2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide
SMILESCOc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)ccn1
InChIInChI=1S/C15H17N3O4S/c1-22-14-10-12(7-9-17-14)15(19)18-8-6-11-2-4-13(5-3-11)23(16,20)21/h2-5,7,9-10H,6,8H2,1H3,(H,18,19)(H2,16,20,21)
InChIKeyRJHQLHTZJITDSP-UHFFFAOYSA-N
XLogP0.71
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.39
LogP ≤ 50.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-(2-phenylethyl)pyridine-4-carboxamide
CID 84580463
2-chloro-6-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide
CID 84576032
2-(3-methoxypropylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide
CID 109167185
N-(2-methoxyethyl)-2-[2-(4-sulfamoylphenyl)ethylamino]pyridine-4-carboxamide
CID 109166763
3-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 670722
4-(111C)methoxy-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 56961355
3,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 2683013
N-[2-(4-sulfamoylphenyl)ethyl]quinoline-7-carboxamide
CID 146077356
3-amino-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 6420184
3-methyl-4-nitro-N-[2-(4-sulfamoylphenyl)ethyl]benzamide
CID 1346453
2-(propan-2-ylamino)-N-[2-(4-sulfamoylphenyl)ethyl]pyrimidine-5-carboxamide
CID 109247115
N-[2-(4-sulfamoylphenyl)ethyl]-1,3-benzoxazole-6-carboxamide
CID 110765059

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide (CID 84580650) is 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide is COc1cc(C(=O)NCCc2ccc(S(N)(=O)=O)cc2)ccn1.
What is the InChIKey of 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide?
The InChIKey is RJHQLHTZJITDSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O4S/c1-22-14-10-12(7-9-17-14)15(19)18-8-6-11-2-4-13(5-3-11)23(16,20)21/h2-5,7,9-10H,6,8H2,1H3,(H,18,19)(H2,16,20,21).
What are the key properties of 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide?
2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide has a molecular weight of 335.39 g/mol, XLogP of 0.71, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[2-(4-sulfamoylphenyl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 84580650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).