N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide

C28H20N2OS — CID 169094498

IUPACN-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccccc1-c1cc2ccccc2cc1Sc1ccccc1)c1ccccn1
InChIInChI=1S/C28H20N2OS/c31-28(26-16-8-9-17-29-26)30-25-15-7-6-14-23(25)24-18-20-10-4-5-11-21(20)19-27(24)32-22-12-2-1-3-13-22/h1-19H,(H,30,31)
InChIKeyVNODPEYUHCPLFS-UHFFFAOYSA-N
MW432.55 g/mol
LogP7.31
Rot. Bonds5

About N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide

N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide (PubChem CID 169094498) has the molecular formula C28H20N2OS and a molecular weight of 432.55 g/mol. Its IUPAC name is N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide
PubChem CID169094498
Molecular FormulaC28H20N2OS
Molecular Weight432.55 g/mol
Exact Mass432.13
IUPAC NameN-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide
SMILESO=C(Nc1ccccc1-c1cc2ccccc2cc1Sc1ccccc1)c1ccccn1
InChIInChI=1S/C28H20N2OS/c31-28(26-16-8-9-17-29-26)30-25-15-7-6-14-23(25)24-18-20-10-4-5-11-21(20)19-27(24)32-22-12-2-1-3-13-22/h1-19H,(H,30,31)
InChIKeyVNODPEYUHCPLFS-UHFFFAOYSA-N
XLogP7.31
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms32
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500432.55
LogP ≤ 57.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-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-[2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide;ruthenium(2+);dichloride
CID 46845295
N-[2-[4-chloro-2,6-bis(phenylselanyl)phenyl]phenyl]pyridine-2-carboxamide
CID 169094448
N-[2-(2-methyl-1,3-thiazol-4-yl)phenyl]pyridine-2-carboxamide
CID 90626104
N-[8-(2-methylphenyl)sulfanylnaphthalen-1-yl]pyridine-2-carboxamide
CID 102531877
4-methyl-3-(pyridine-2-carbonylamino)benzoic acid
CID 16771811
5-chloro-2-hydroxy-N-(2-phenylsulfanylphenyl)benzamide
CID 3059478
N-[8-(4-tert-butylphenyl)naphthalen-1-yl]pyridine-2-carboxamide
CID 72714120
N-(6-bromo-2-methyl-3-pyridinyl)pyridine-2-carboxamide
CID 103909689
N-(2-chloro-3-pyridinyl)-N'-(2-phenylsulfanylphenyl)oxamide
CID 108515125
N-[2-(aminomethyl)phenyl]pyridine-2-carboxamide
CID 16773462
N-[4,5-dimethoxy-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 102266460
N-[4-methyl-2-(pyridine-2-carbonylamino)phenyl]pyridine-2-carboxamide
CID 4867706

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide?
The IUPAC name of N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide (CID 169094498) is N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide?
The canonical SMILES for N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide is O=C(Nc1ccccc1-c1cc2ccccc2cc1Sc1ccccc1)c1ccccn1.
What is the InChIKey of N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide?
The InChIKey is VNODPEYUHCPLFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H20N2OS/c31-28(26-16-8-9-17-29-26)30-25-15-7-6-14-23(25)24-18-20-10-4-5-11-21(20)19-27(24)32-22-12-2-1-3-13-22/h1-19H,(H,30,31).
What are the key properties of N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide?
N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide has a molecular weight of 432.55 g/mol, XLogP of 7.31, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-phenylsulfanylnaphthalen-2-yl)phenyl]pyridine-2-carboxamide is sourced from PubChem (CID 169094498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).