2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide

C10H15N3OS — CID 86772032

IUPAC2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
SMILESCSCC(=O)NC1CCc2nccn2C1
InChIInChI=1S/C10H15N3OS/c1-15-7-10(14)12-8-2-3-9-11-4-5-13(9)6-8/h4-5,8H,2-3,6-7H2,1H3,(H,12,14)
InChIKeyKKTCKCXTLSOOHW-UHFFFAOYSA-N
MW225.32 g/mol
LogP0.68
Rot. Bonds3

About 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide

2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide (PubChem CID 86772032) has the molecular formula C10H15N3OS and a molecular weight of 225.32 g/mol. Its IUPAC name is 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide.

Molecular Properties

Compound Name2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
PubChem CID86772032
Molecular FormulaC10H15N3OS
Molecular Weight225.32 g/mol
Exact Mass225.09
IUPAC Name2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide
SMILESCSCC(=O)NC1CCc2nccn2C1
InChIInChI=1S/C10H15N3OS/c1-15-7-10(14)12-8-2-3-9-11-4-5-13(9)6-8/h4-5,8H,2-3,6-7H2,1H3,(H,12,14)
InChIKeyKKTCKCXTLSOOHW-UHFFFAOYSA-N
XLogP0.68
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.32
LogP ≤ 50.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide?
The IUPAC name of 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide (CID 86772032) is 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide.
What is the SMILES notation for 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide?
The canonical SMILES for 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide is CSCC(=O)NC1CCc2nccn2C1.
What is the InChIKey of 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide?
The InChIKey is KKTCKCXTLSOOHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3OS/c1-15-7-10(14)12-8-2-3-9-11-4-5-13(9)6-8/h4-5,8H,2-3,6-7H2,1H3,(H,12,14).
What are the key properties of 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide?
2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide has a molecular weight of 225.32 g/mol, XLogP of 0.68, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylsulfanyl-N-(5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)acetamide is sourced from PubChem (CID 86772032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).