N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide

C15H16N2OS — CID 46925872

IUPACN-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide
SMILESCC(=O)Nc1sc2c(c1-c1ccccc1)CCNC2
InChIInChI=1S/C15H16N2OS/c1-10(18)17-15-14(11-5-3-2-4-6-11)12-7-8-16-9-13(12)19-15/h2-6,16H,7-9H2,1H3,(H,17,18)
InChIKeyQLDNITRHYRYWQH-UHFFFAOYSA-N
MW272.37 g/mol
LogP3.02
Rot. Bonds2

About N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide

N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide (PubChem CID 46925872) has the molecular formula C15H16N2OS and a molecular weight of 272.37 g/mol. Its IUPAC name is N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide.

Molecular Properties

Compound NameN-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide
PubChem CID46925872
Molecular FormulaC15H16N2OS
Molecular Weight272.37 g/mol
Exact Mass272.10
IUPAC NameN-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide
SMILESCC(=O)Nc1sc2c(c1-c1ccccc1)CCNC2
InChIInChI=1S/C15H16N2OS/c1-10(18)17-15-14(11-5-3-2-4-6-11)12-7-8-16-9-13(12)19-15/h2-6,16H,7-9H2,1H3,(H,17,18)
InChIKeyQLDNITRHYRYWQH-UHFFFAOYSA-N
XLogP3.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.37
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide?
The IUPAC name of N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide (CID 46925872) is N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide.
What is the SMILES notation for N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide?
The canonical SMILES for N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide is CC(=O)Nc1sc2c(c1-c1ccccc1)CCNC2.
What is the InChIKey of N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide?
The InChIKey is QLDNITRHYRYWQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2OS/c1-10(18)17-15-14(11-5-3-2-4-6-11)12-7-8-16-9-13(12)19-15/h2-6,16H,7-9H2,1H3,(H,17,18).
What are the key properties of N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide?
N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide has a molecular weight of 272.37 g/mol, XLogP of 3.02, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-phenyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)acetamide is sourced from PubChem (CID 46925872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).