2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine

C17H17N3S — CID 71256323

IUPAC2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine
SMILESc1ccc(-c2nc3ccc(N4CCCCC4)nc3s2)cc1
InChIInChI=1S/C17H17N3S/c1-3-7-13(8-4-1)16-18-14-9-10-15(19-17(14)21-16)20-11-5-2-6-12-20/h1,3-4,7-10H,2,5-6,11-12H2
InChIKeyAJJXTQAQJGUWOZ-UHFFFAOYSA-N
MW295.41 g/mol
LogP4.35
Rot. Bonds2

About 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine

2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine (PubChem CID 71256323) has the molecular formula C17H17N3S and a molecular weight of 295.41 g/mol. Its IUPAC name is 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine.

Molecular Properties

Compound Name2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine
PubChem CID71256323
Molecular FormulaC17H17N3S
Molecular Weight295.41 g/mol
Exact Mass295.11
IUPAC Name2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine
SMILESc1ccc(-c2nc3ccc(N4CCCCC4)nc3s2)cc1
InChIInChI=1S/C17H17N3S/c1-3-7-13(8-4-1)16-18-14-9-10-15(19-17(14)21-16)20-11-5-2-6-12-20/h1,3-4,7-10H,2,5-6,11-12H2
InChIKeyAJJXTQAQJGUWOZ-UHFFFAOYSA-N
XLogP4.35
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.41
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-Benzylpiperazin-1-yl)-1,3-benzothiazole
CID 1484933
12-methyl-4-phenyl-N-[2-(piperidin-1-yl)ethyl]-3-thia-1,7,10-triazatricyclo[7.3.0.0^{2,6}]dodeca-2(6),4,7,9,11-pentaen-8-amine
CID 20823975
3M-002
CID 10198719
S-21007
CID 9863146
8-(4-Benzylpiperazin-1-yl)-5-thia-1,7-diazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaene
CID 10247171
10-(4,5-Dimethyl-thiazol-2-yl)-4-(4-phenethyl-piperazin-1-yl)-6,7,8,9-tetrahydro-pyrimido[4,5-b]indolizine
CID 10344755
CID 10621131
CID 10621131
2-Methyl-6-phenyl-4-piperidin-1-yl-thieno[3,2-d]pyrimidine
CID 10638643
2-(1,4''-Bipiperidin-1''-yl)-6-(6-methylpyridin-3-yl)thiazolo[4,5-c]pyridine
CID 45482709
5-(2-(1,4''-Bipiperidin-1''-yl)thiazolo[4,5-c]pyridin-6-yl)pyridin-2-amine
CID 45482746
4-(1,3-benzothiazol-2-yl)-N-(4,6-dimethyl-2-pyridinyl)piperazine-1-carbothioamide
CID 49852812
4-[4-(4-methylpiperazin-1-yl)phenyl]-N-(6-methyl-2-pyridinyl)-1,3-thiazol-2-amine
CID 89423092

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine?
The IUPAC name of 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine (CID 71256323) is 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine.
What is the SMILES notation for 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine?
The canonical SMILES for 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine is c1ccc(-c2nc3ccc(N4CCCCC4)nc3s2)cc1.
What is the InChIKey of 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine?
The InChIKey is AJJXTQAQJGUWOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3S/c1-3-7-13(8-4-1)16-18-14-9-10-15(19-17(14)21-16)20-11-5-2-6-12-20/h1,3-4,7-10H,2,5-6,11-12H2.
What are the key properties of 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine?
2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine has a molecular weight of 295.41 g/mol, XLogP of 4.35, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-5-piperidin-1-yl-[1,3]thiazolo[5,4-b]pyridine is sourced from PubChem (CID 71256323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).