N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide

C19H21N3O3S — CID 142611651

IUPACN-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide
SMILESCSc1ncccc1C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1C
InChIInChI=1S/C19H21N3O3S/c1-13-5-6-14(19(24)22-8-10-25-11-9-22)12-16(13)21-17(23)15-4-3-7-20-18(15)26-2/h3-7,12H,8-11H2,1-2H3,(H,21,23)
InChIKeyHHITXAKNHIONQH-UHFFFAOYSA-N
MW371.46 g/mol
LogP2.84
Rot. Bonds4

About N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide

N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide (PubChem CID 142611651) has the molecular formula C19H21N3O3S and a molecular weight of 371.46 g/mol. Its IUPAC name is N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide
PubChem CID142611651
Molecular FormulaC19H21N3O3S
Molecular Weight371.46 g/mol
Exact Mass371.13
IUPAC NameN-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide
SMILESCSc1ncccc1C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1C
InChIInChI=1S/C19H21N3O3S/c1-13-5-6-14(19(24)22-8-10-25-11-9-22)12-16(13)21-17(23)15-4-3-7-20-18(15)26-2/h3-7,12H,8-11H2,1-2H3,(H,21,23)
InChIKeyHHITXAKNHIONQH-UHFFFAOYSA-N
XLogP2.84
TPSA71.53 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.46
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-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

2-methylsulfanyl-N-[4-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide
CID 155647773
4-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]pyridine-3-carboxamide
CID 136527988
N-[2-methoxy-5-(morpholine-4-carbonyl)phenyl]-2-methylbenzamide
CID 50875897
N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 3985764
2-fluoro-N-[2-methyl-5-[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]phenyl]benzamide
CID 39290700
N-(4-fluoro-2-methylphenyl)-2-methylsulfanylpyridine-3-carboxamide
CID 8866395
1-methyl-N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-oxo-3H-benzimidazole-5-carboxamide
CID 154794308
N-[4-chloro-3-(pyrrolidine-1-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 155382799
N-[4-chloro-3-(piperidine-1-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 155382960
2-(2,5-dimethylphenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24628498
N-[2-methyl-5-[(2-methylsulfanyl-3-pyridinyl)carbamoyl]phenyl]-1,2-thiazole-5-carboxamide
CID 172657474
2-fluoro-N-[5-(morpholine-4-carbonyl)-2-pyrrolidin-1-ylphenyl]benzamide
CID 3953635

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide?
The IUPAC name of N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide (CID 142611651) is N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide.
What is the SMILES notation for N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide?
The canonical SMILES for N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide is CSc1ncccc1C(=O)Nc1cc(C(=O)N2CCOCC2)ccc1C.
What is the InChIKey of N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide?
The InChIKey is HHITXAKNHIONQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21N3O3S/c1-13-5-6-14(19(24)22-8-10-25-11-9-22)12-16(13)21-17(23)15-4-3-7-20-18(15)26-2/h3-7,12H,8-11H2,1-2H3,(H,21,23).
What are the key properties of N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide?
N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide has a molecular weight of 371.46 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-5-(morpholine-4-carbonyl)phenyl]-2-methylsulfanylpyridine-3-carboxamide is sourced from PubChem (CID 142611651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).