N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide

C14H17N3OS — CID 152974295

IUPACN-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide
SMILESCCC1CCc2nc3sc(NC(C)=O)nc3cc2C1
InChIInChI=1S/C14H17N3OS/c1-3-9-4-5-11-10(6-9)7-12-13(16-11)19-14(17-12)15-8(2)18/h7,9H,3-6H2,1-2H3,(H,15,17,18)
InChIKeyUTCFUYNFDFVYNO-UHFFFAOYSA-N
MW275.38 g/mol
LogP3.16
Rot. Bonds2

About N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide

N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide (PubChem CID 152974295) has the molecular formula C14H17N3OS and a molecular weight of 275.38 g/mol. Its IUPAC name is N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide.

Molecular Properties

Compound NameN-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide
PubChem CID152974295
Molecular FormulaC14H17N3OS
Molecular Weight275.38 g/mol
Exact Mass275.11
IUPAC NameN-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide
SMILESCCC1CCc2nc3sc(NC(C)=O)nc3cc2C1
InChIInChI=1S/C14H17N3OS/c1-3-9-4-5-11-10(6-9)7-12-13(16-11)19-14(17-12)15-8(2)18/h7,9H,3-6H2,1-2H3,(H,15,17,18)
InChIKeyUTCFUYNFDFVYNO-UHFFFAOYSA-N
XLogP3.16
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.38
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide?
The IUPAC name of N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide (CID 152974295) is N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide.
What is the SMILES notation for N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide?
The canonical SMILES for N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide is CCC1CCc2nc3sc(NC(C)=O)nc3cc2C1.
What is the InChIKey of N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide?
The InChIKey is UTCFUYNFDFVYNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3OS/c1-3-9-4-5-11-10(6-9)7-12-13(16-11)19-14(17-12)15-8(2)18/h7,9H,3-6H2,1-2H3,(H,15,17,18).
What are the key properties of N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide?
N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide has a molecular weight of 275.38 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(7-ethyl-5,6,7,8-tetrahydro-[1,3]thiazolo[5,4-b]quinolin-2-yl)acetamide is sourced from PubChem (CID 152974295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).