6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide

C10H15N3OS — CID 173092760

IUPAC6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide
SMILESCN(C)CCSc1cccc(C(N)=O)n1
InChIInChI=1S/C10H15N3OS/c1-13(2)6-7-15-9-5-3-4-8(12-9)10(11)14/h3-5H,6-7H2,1-2H3,(H2,11,14)
InChIKeyRXCCGESOTZCPAI-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.83
Rot. Bonds5

About 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide

6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide (PubChem CID 173092760) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide
PubChem CID173092760
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide
SMILESCN(C)CCSc1cccc(C(N)=O)n1
InChIInChI=1S/C10H15N3OS/c1-13(2)6-7-15-9-5-3-4-8(12-9)10(11)14/h3-5H,6-7H2,1-2H3,(H2,11,14)
InChIKeyRXCCGESOTZCPAI-UHFFFAOYSA-N
XLogP0.83
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide?
The IUPAC name of 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide (CID 173092760) is 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide.
What is the SMILES notation for 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide?
The canonical SMILES for 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide is CN(C)CCSc1cccc(C(N)=O)n1.
What is the InChIKey of 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide?
The InChIKey is RXCCGESOTZCPAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-13(2)6-7-15-9-5-3-4-8(12-9)10(11)14/h3-5H,6-7H2,1-2H3,(H2,11,14).
What are the key properties of 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide?
6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide has a molecular weight of 225.32 g/mol, XLogP of 0.83, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(dimethylamino)ethylsulfanyl]pyridine-2-carboxamide is sourced from PubChem (CID 173092760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).