N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide

C16H14N4O2S — CID 91625946

IUPACN-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1ccc(-c2cccnc2)nc1)c1cccnc1
InChIInChI=1S/C16H14N4O2S/c21-23(22,15-4-2-8-18-12-15)20-10-13-5-6-16(19-9-13)14-3-1-7-17-11-14/h1-9,11-12,20H,10H2
InChIKeyYHORLVKXTAZCST-UHFFFAOYSA-N
MW326.38 g/mol
LogP2.02
Rot. Bonds5

About N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide

N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide (PubChem CID 91625946) has the molecular formula C16H14N4O2S and a molecular weight of 326.38 g/mol. Its IUPAC name is N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide.

Molecular Properties

Compound NameN-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide
PubChem CID91625946
Molecular FormulaC16H14N4O2S
Molecular Weight326.38 g/mol
Exact Mass326.08
IUPAC NameN-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide
SMILESO=S(=O)(NCc1ccc(-c2cccnc2)nc1)c1cccnc1
InChIInChI=1S/C16H14N4O2S/c21-23(22,15-4-2-8-18-12-15)20-10-13-5-6-16(19-9-13)14-3-1-7-17-11-14/h1-9,11-12,20H,10H2
InChIKeyYHORLVKXTAZCST-UHFFFAOYSA-N
XLogP2.02
TPSA84.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.38
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide 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

3,4-dimethoxy-N-[(6-pyridin-3-yl-3-pyridinyl)methyl]benzenesulfonamide
CID 91816113
N-[(2-pyridin-4-yl-4-pyridinyl)methyl]pyridine-3-sulfonamide
CID 121018139
N-[[4-(difluoromethoxy)phenyl]methyl]pyridine-3-sulfonamide
CID 3823851
N-[[4-(5-pyridin-3-yl-1,3,4-oxadiazol-2-yl)phenyl]methyl]benzenesulfonamide
CID 69469895
4-(2-chloroethyl)-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 28719352
4-(2-bromoethyl)-N-(pyridin-3-ylmethyl)benzenesulfonamide
CID 23112086
N-(1H-indol-5-ylmethyl)pyridine-3-sulfonamide
CID 169029432
N-[3-(pyridin-3-ylmethylamino)propyl]pyridine-3-sulfonamide
CID 43605828
2-(2-chlorophenyl)-N-[(6-pyridin-3-yl-3-pyridinyl)methyl]acetamide
CID 91625896
N-[(2-methylphenyl)methyl]pyridine-3-sulfonamide
CID 110865640
N-[5-(aminomethyl)-2-pyridinyl]pyridine-3-sulfonamide
CID 62353333
N-propylpyridine-3-sulfonamide
CID 43258995

Frequently Asked Questions

What is the IUPAC name of N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide?
The IUPAC name of N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide (CID 91625946) is N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide.
What is the SMILES notation for N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide?
The canonical SMILES for N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide is O=S(=O)(NCc1ccc(-c2cccnc2)nc1)c1cccnc1.
What is the InChIKey of N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide?
The InChIKey is YHORLVKXTAZCST-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2S/c21-23(22,15-4-2-8-18-12-15)20-10-13-5-6-16(19-9-13)14-3-1-7-17-11-14/h1-9,11-12,20H,10H2.
What are the key properties of N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide?
N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide has a molecular weight of 326.38 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(6-pyridin-3-yl-3-pyridinyl)methyl]pyridine-3-sulfonamide is sourced from PubChem (CID 91625946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).