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

C18H17N5O3S — CID 118249335

IUPACN-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)Nc3ccccc3)c2)ccn1
InChIInChI=1S/C18H17N5O3S/c1-12(24)22-17-10-13(7-8-20-17)14-9-16(18(19)21-11-14)27(25,26)23-15-5-3-2-4-6-15/h2-11,23H,1H3,(H2,19,21)(H,20,22,24)
InChIKeyPCXGLGQSYXZXKO-UHFFFAOYSA-N
MW383.43 g/mol
LogP2.48
Rot. Bonds5

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

N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide (PubChem CID 118249335) has the molecular formula C18H17N5O3S and a molecular weight of 383.43 g/mol. Its IUPAC name is N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide.

Molecular Properties

Compound NameN-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide
PubChem CID118249335
Molecular FormulaC18H17N5O3S
Molecular Weight383.43 g/mol
Exact Mass383.11
IUPAC NameN-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide
SMILESCC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)Nc3ccccc3)c2)ccn1
InChIInChI=1S/C18H17N5O3S/c1-12(24)22-17-10-13(7-8-20-17)14-9-16(18(19)21-11-14)27(25,26)23-15-5-3-2-4-6-15/h2-11,23H,1H3,(H2,19,21)(H,20,22,24)
InChIKeyPCXGLGQSYXZXKO-UHFFFAOYSA-N
XLogP2.48
TPSA127.07 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.43
LogP ≤ 52.48
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-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
The IUPAC name of N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide (CID 118249335) is N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide.
What is the SMILES notation for N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
The canonical SMILES for N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide is CC(=O)Nc1cc(-c2cnc(N)c(S(=O)(=O)Nc3ccccc3)c2)ccn1.
What is the InChIKey of N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
The InChIKey is PCXGLGQSYXZXKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N5O3S/c1-12(24)22-17-10-13(7-8-20-17)14-9-16(18(19)21-11-14)27(25,26)23-15-5-3-2-4-6-15/h2-11,23H,1H3,(H2,19,21)(H,20,22,24).
What are the key properties of N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide?
N-[4-[6-amino-5-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide has a molecular weight of 383.43 g/mol, XLogP of 2.48, 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-(phenylsulfamoyl)-3-pyridinyl]-2-pyridinyl]acetamide is sourced from PubChem (CID 118249335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).