5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide

C10H15N3OS — CID 71553032

IUPAC5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide
SMILESCN(C)c1ccc(C(=O)NCCS)nc1
InChIInChI=1S/C10H15N3OS/c1-13(2)8-3-4-9(12-7-8)10(14)11-5-6-15/h3-4,7,15H,5-6H2,1-2H3,(H,11,14)
InChIKeySXMYUFZNZKIDBV-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.81
Rot. Bonds4

About 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide

5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide (PubChem CID 71553032) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide
PubChem CID71553032
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide
SMILESCN(C)c1ccc(C(=O)NCCS)nc1
InChIInChI=1S/C10H15N3OS/c1-13(2)8-3-4-9(12-7-8)10(14)11-5-6-15/h3-4,7,15H,5-6H2,1-2H3,(H,11,14)
InChIKeySXMYUFZNZKIDBV-UHFFFAOYSA-N
XLogP0.81
TPSA45.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

5-[butyl(methyl)amino]-N-[3-(dimethylamino)propyl]pyridine-2-carboxamide
CID 109185972
1-[5-(dimethylamino)-2-pyridinyl]ethanone
CID 45086299
5-[butyl(methyl)amino]-N-pentylpyridine-2-carboxamide
CID 109195719
5-[4-(dimethylamino)anilino]-N-(2-methylpropyl)pyridine-2-carboxamide
CID 109181155
2-N-[2-(dimethylamino)ethyl]-6-N-[4-(dimethylamino)phenyl]pyridine-2,6-dicarboxamide
CID 109096394
N-[3-(dimethylamino)propyl]-5-(N-ethyl-3-methylanilino)pyridine-2-carboxamide
CID 109186079
N-[2-[ethyl(methyl)amino]ethyl]-5-(methylamino)pyridine-2-carboxamide
CID 104641145
N-[5-(dimethylamino)pentyl]-5-(123I)iodopyridine-2-carboxamide
CID 154026036
N-[6-(dimethylamino)hexyl]-5-(124I)iodopyridine-2-carboxamide
CID 154026042
5-(cycloheptylamino)-N-[2-(dimethylamino)ethyl]pyridine-2-carboxamide
CID 109185339
5-[benzyl(methyl)amino]-N-[2-(3-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109189231
N-[4-(dimethylamino)phenyl]-5-(2-methoxyethylamino)pyridine-2-carboxamide
CID 109184150

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide?
The IUPAC name of 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide (CID 71553032) is 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide is CN(C)c1ccc(C(=O)NCCS)nc1.
What is the InChIKey of 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide?
The InChIKey is SXMYUFZNZKIDBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-13(2)8-3-4-9(12-7-8)10(14)11-5-6-15/h3-4,7,15H,5-6H2,1-2H3,(H,11,14).
What are the key properties of 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide?
5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide has a molecular weight of 225.32 g/mol, XLogP of 0.81, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-N-(2-sulfanylethyl)pyridine-2-carboxamide is sourced from PubChem (CID 71553032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).