2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine

C16H19N3OS — CID 106820672

IUPAC2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine
SMILESc1ccc(N2CCc3nc(C4CNCCO4)sc3C2)cc1
InChIInChI=1S/C16H19N3OS/c1-2-4-12(5-3-1)19-8-6-13-15(11-19)21-16(18-13)14-10-17-7-9-20-14/h1-5,14,17H,6-11H2
InChIKeyMAIMNKXVQSHSIW-UHFFFAOYSA-N
MW301.41 g/mol
LogP2.37
Rot. Bonds2

About 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine

2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine (PubChem CID 106820672) has the molecular formula C16H19N3OS and a molecular weight of 301.41 g/mol. Its IUPAC name is 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine.

Molecular Properties

Compound Name2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine
PubChem CID106820672
Molecular FormulaC16H19N3OS
Molecular Weight301.41 g/mol
Exact Mass301.12
IUPAC Name2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine
SMILESc1ccc(N2CCc3nc(C4CNCCO4)sc3C2)cc1
InChIInChI=1S/C16H19N3OS/c1-2-4-12(5-3-1)19-8-6-13-15(11-19)21-16(18-13)14-10-17-7-9-20-14/h1-5,14,17H,6-11H2
InChIKeyMAIMNKXVQSHSIW-UHFFFAOYSA-N
XLogP2.37
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.41
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine?
The IUPAC name of 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine (CID 106820672) is 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine.
What is the SMILES notation for 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine?
The canonical SMILES for 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine is c1ccc(N2CCc3nc(C4CNCCO4)sc3C2)cc1.
What is the InChIKey of 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine?
The InChIKey is MAIMNKXVQSHSIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3OS/c1-2-4-12(5-3-1)19-8-6-13-15(11-19)21-16(18-13)14-10-17-7-9-20-14/h1-5,14,17H,6-11H2.
What are the key properties of 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine?
2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine has a molecular weight of 301.41 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-phenyl-6,7-dihydro-4H-[1,3]thiazolo[5,4-c]pyridin-2-yl)morpholine is sourced from PubChem (CID 106820672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).