5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide

C15H17N3OS — CID 107643013

IUPAC5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccccc2SC)nc1
InChIInChI=1S/C15H17N3OS/c1-3-16-11-8-9-13(17-10-11)15(19)18-12-6-4-5-7-14(12)20-2/h4-10,16H,3H2,1-2H3,(H,18,19)
InChIKeyJLONEONLOUAWNX-UHFFFAOYSA-N
MW287.39 g/mol
LogP3.49
Rot. Bonds5

About 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide

5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide (PubChem CID 107643013) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide
PubChem CID107643013
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC Name5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide
SMILESCCNc1ccc(C(=O)Nc2ccccc2SC)nc1
InChIInChI=1S/C15H17N3OS/c1-3-16-11-8-9-13(17-10-11)15(19)18-12-6-4-5-7-14(12)20-2/h4-10,16H,3H2,1-2H3,(H,18,19)
InChIKeyJLONEONLOUAWNX-UHFFFAOYSA-N
XLogP3.49
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-(ethylamino)-N-(2-methylphenyl)pyridine-2-carboxamide
CID 104640059
5-(ethylamino)-N-(2-methoxyphenyl)pyridine-2-carboxamide
CID 104639682
5-amino-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide
CID 81317409
N-(2-methylsulfanylphenyl)-5-(propylamino)pyrazine-2-carboxamide
CID 107643075
5-amino-N-(2-methylsulfanylphenyl)pyrazine-2-carboxamide
CID 113381839
N-(5-chloro-2-fluorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640210
5-(ethylamino)-N-methylpyridine-2-carboxamide
CID 104639889
N-(2-bromo-4-fluorophenyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640072
5-(butylamino)-N-(2-fluorophenyl)pyridine-2-carboxamide
CID 109180924
5-(ethylamino)-N-(2,3,5-trifluorophenyl)pyridine-2-carboxamide
CID 104641163
5-(ethylamino)-N-(2-fluoro-5-methylphenyl)pyridine-2-carboxamide
CID 104640093
6-ethoxy-N-(2-methylsulfanylphenyl)pyridazine-3-carboxamide
CID 90509597

Frequently Asked Questions

What is the IUPAC name of 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide?
The IUPAC name of 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide (CID 107643013) is 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide is CCNc1ccc(C(=O)Nc2ccccc2SC)nc1.
What is the InChIKey of 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide?
The InChIKey is JLONEONLOUAWNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c1-3-16-11-8-9-13(17-10-11)15(19)18-12-6-4-5-7-14(12)20-2/h4-10,16H,3H2,1-2H3,(H,18,19).
What are the key properties of 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide?
5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide has a molecular weight of 287.39 g/mol, XLogP of 3.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(ethylamino)-N-(2-methylsulfanylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 107643013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).