N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide

C14H14FN3OS — CID 82155272

IUPACN-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
SMILESO=C(Cc1nc2c(s1)CNCC2)Nc1ccccc1F
InChIInChI=1S/C14H14FN3OS/c15-9-3-1-2-4-10(9)17-13(19)7-14-18-11-5-6-16-8-12(11)20-14/h1-4,16H,5-8H2,(H,17,19)
InChIKeyZQEHVVOJCNRIGJ-UHFFFAOYSA-N
MW291.35 g/mol
LogP2.11
Rot. Bonds3

About N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide

N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide (PubChem CID 82155272) has the molecular formula C14H14FN3OS and a molecular weight of 291.35 g/mol. Its IUPAC name is N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
PubChem CID82155272
Molecular FormulaC14H14FN3OS
Molecular Weight291.35 g/mol
Exact Mass291.08
IUPAC NameN-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide
SMILESO=C(Cc1nc2c(s1)CNCC2)Nc1ccccc1F
InChIInChI=1S/C14H14FN3OS/c15-9-3-1-2-4-10(9)17-13(19)7-14-18-11-5-6-16-8-12(11)20-14/h1-4,16H,5-8H2,(H,17,19)
InChIKeyZQEHVVOJCNRIGJ-UHFFFAOYSA-N
XLogP2.11
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.35
LogP ≤ 52.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide?
The IUPAC name of N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide (CID 82155272) is N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide.
What is the SMILES notation for N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide?
The canonical SMILES for N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide is O=C(Cc1nc2c(s1)CNCC2)Nc1ccccc1F.
What is the InChIKey of N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide?
The InChIKey is ZQEHVVOJCNRIGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3OS/c15-9-3-1-2-4-10(9)17-13(19)7-14-18-11-5-6-16-8-12(11)20-14/h1-4,16H,5-8H2,(H,17,19).
What are the key properties of N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide?
N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide has a molecular weight of 291.35 g/mol, XLogP of 2.11, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-2-(4,5,6,7-tetrahydro-[1,3]thiazolo[5,4-c]pyridin-2-yl)acetamide is sourced from PubChem (CID 82155272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).