N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine

C21H19N5OS — CID 87944575

IUPACN-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESc1cc(-c2ccc3nc(Nc4cc(OC5CCCC5)ccn4)sc3n2)ccn1
InChIInChI=1S/C21H19N5OS/c1-2-4-15(3-1)27-16-9-12-23-19(13-16)26-21-25-18-6-5-17(24-20(18)28-21)14-7-10-22-11-8-14/h5-13,15H,1-4H2,(H,23,25,26)
InChIKeyMWLYDGTYQAETFO-UHFFFAOYSA-N
MW389.48 g/mol
LogP5.21
Rot. Bonds5

About N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine

N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine (PubChem CID 87944575) has the molecular formula C21H19N5OS and a molecular weight of 389.48 g/mol. Its IUPAC name is N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine.

Molecular Properties

Compound NameN-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
PubChem CID87944575
Molecular FormulaC21H19N5OS
Molecular Weight389.48 g/mol
Exact Mass389.13
IUPAC NameN-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESc1cc(-c2ccc3nc(Nc4cc(OC5CCCC5)ccn4)sc3n2)ccn1
InChIInChI=1S/C21H19N5OS/c1-2-4-15(3-1)27-16-9-12-23-19(13-16)26-21-25-18-6-5-17(24-20(18)28-21)14-7-10-22-11-8-14/h5-13,15H,1-4H2,(H,23,25,26)
InChIKeyMWLYDGTYQAETFO-UHFFFAOYSA-N
XLogP5.21
TPSA72.82 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500389.48
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine with MolForge

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Related Compounds

N-[4-(propan-2-yloxymethyl)-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87944735
N-[4-(4-methylsulfinylpiperazin-1-yl)-2-pyridinyl]-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 134422625
6-N-cyclohexyl-2-N-(5-phenyl-[1,3]thiazolo[5,4-b]pyridin-2-yl)pyridine-2,6-diamine
CID 88900367
5-pyridin-4-yl-N-[4-[4-(3,3,3-trifluoropropyl)piperazin-1-yl]-2-pyridinyl]-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87944732
2-propan-2-yloxy-1-[4-[2-[(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)amino]-4-pyridinyl]piperazin-1-yl]ethanone
CID 87944549
N-[4-(4-methylsulfonylazepan-1-yl)-2-pyridinyl]-5-pyridazin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 135295325
[2-[[5-(1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-yl]amino]-4-pyridinyl]methanol
CID 87945629
4-methyl-N-(4-piperidin-4-yloxy-2-pyridinyl)-1,3-thiazol-2-amine
CID 24826060
N-(4-piperazin-1-yl-2-pyridinyl)-5-(1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87945651
N-(4-cyclopentyloxy-2-pyridinyl)-6-(5-methyl-1H-pyrazol-4-yl)-8,9-dihydrocycloocta[d][1,3]thiazol-2-amine
CID 123196404
4-(2-methoxyethyl)-4-N-methyl-2-N-(5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl)-3H-pyridine-2,4-diamine
CID 154378968
N-[4-(4-benzylpiperazin-1-yl)-2-pyridinyl]-5-(1H-pyrazol-4-yl)-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 87945561

Frequently Asked Questions

What is the IUPAC name of N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The IUPAC name of N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine (CID 87944575) is N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine.
What is the SMILES notation for N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The canonical SMILES for N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine is c1cc(-c2ccc3nc(Nc4cc(OC5CCCC5)ccn4)sc3n2)ccn1.
What is the InChIKey of N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The InChIKey is MWLYDGTYQAETFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19N5OS/c1-2-4-15(3-1)27-16-9-12-23-19(13-16)26-21-25-18-6-5-17(24-20(18)28-21)14-7-10-22-11-8-14/h5-13,15H,1-4H2,(H,23,25,26).
What are the key properties of N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine has a molecular weight of 389.48 g/mol, XLogP of 5.21, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyclopentyloxy-2-pyridinyl)-5-pyridin-4-yl-[1,3]thiazolo[5,4-b]pyridin-2-amine is sourced from PubChem (CID 87944575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).