N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide

C22H19N5O3S — CID 118293603

IUPACN-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)Nc3ccc4ccccc4c3)c2)ccn1
InChIInChI=1S/C22H19N5O3S/c1-14(28)26-21-12-17(8-9-24-21)18-11-20(22(23)25-13-18)31(29,30)27-19-7-6-15-4-2-3-5-16(15)10-19/h2-13,27H,1H3,(H2,23,25)(H,24,26,28)
InChIKeyYJVONAPDUSQJFJ-UHFFFAOYSA-N
MW433.49 g/mol
LogP3.64
Rot. Bonds5

About N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide

N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide (PubChem CID 118293603) has the molecular formula C22H19N5O3S and a molecular weight of 433.49 g/mol. Its IUPAC name is N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide
PubChem CID118293603
Molecular FormulaC22H19N5O3S
Molecular Weight433.49 g/mol
Exact Mass433.12
IUPAC NameN-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)Nc3ccc4ccccc4c3)c2)ccn1
InChIInChI=1S/C22H19N5O3S/c1-14(28)26-21-12-17(8-9-24-21)18-11-20(22(23)25-13-18)31(29,30)27-19-7-6-15-4-2-3-5-16(15)10-19/h2-13,27H,1H3,(H2,23,25)(H,24,26,28)
InChIKeyYJVONAPDUSQJFJ-UHFFFAOYSA-N
XLogP3.64
TPSA127.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500433.49
LogP ≤ 53.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide (CID 118293603) is N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide is CC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)Nc3ccc4ccccc4c3)c2)ccn1.
What is the InChIKey of N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
The InChIKey is YJVONAPDUSQJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O3S/c1-14(28)26-21-12-17(8-9-24-21)18-11-20(22(23)25-13-18)31(29,30)27-19-7-6-15-4-2-3-5-16(15)10-19/h2-13,27H,1H3,(H2,23,25)(H,24,26,28).
What are the key properties of N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide has a molecular weight of 433.49 g/mol, XLogP of 3.64, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[6-amino-5-(naphthalen-2-ylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide is sourced from PubChem (CID 118293603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).