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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Related Compounds

N-(2-methylsulfanylphenyl)pyridine-2-carboxamide
CID 2442932
N-[3-(methylsulfanyl)phenyl]pyridine-2-carboxamide
CID 2441036
6-Isobutylsulfanyl-pyridine-2-carboxylic acid ((S)-1-carbamoyl-3-methyl-butyl)-amide
CID 71105714
6-(2-Methyl-propane-1-sulfonyl)-pyridine-2-carboxylic acid ((S)-1-carbamoyl-3-methyl-butyl)-amide
CID 71105715
2-N,6-N-bis(2-methylsulfanylethyl)pyridine-2,6-dicarboxamide
CID 15905954
2-N,6-N-bis(2-tert-butylsulfanylethyl)pyridine-2,6-dicarboxamide
CID 24936103
(6-Methyl-2-pyridinyl)-[2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
CID 72145441
S-methyl 6-carbamoylpyridine-2-carbothioate
CID 86063595
N-[(4-methyl-1,3-thiazol-2-yl)methyl]pyridine-2-carboxamide
CID 29526926
N-(4-methylsulfanylphenyl)pyridine-2-carboxamide
CID 9153414
6-chloro-3-ethylsulfanyl-N-methylpyridine-2-carboxamide
CID 129206056
5-Ethylthiopicolinanilide
CID 129686817

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).