N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine

C14H23N3OSSi — CID 90924340

IUPACN-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine
SMILESCCCC[Si](C)(C)OCCNc1ccc2ncsc2n1
InChIInChI=1S/C14H23N3OSSi/c1-4-5-10-20(2,3)18-9-8-15-13-7-6-12-14(17-13)19-11-16-12/h6-7,11H,4-5,8-10H2,1-3H3,(H,15,17)
InChIKeyAEJMKOSFSGTEDU-UHFFFAOYSA-N
MW309.51 g/mol
LogP4.12
Rot. Bonds8

About N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine

N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine (PubChem CID 90924340) has the molecular formula C14H23N3OSSi and a molecular weight of 309.51 g/mol. Its IUPAC name is N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine.

Molecular Properties

Compound NameN-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine
PubChem CID90924340
Molecular FormulaC14H23N3OSSi
Molecular Weight309.51 g/mol
Exact Mass309.13
IUPAC NameN-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine
SMILESCCCC[Si](C)(C)OCCNc1ccc2ncsc2n1
InChIInChI=1S/C14H23N3OSSi/c1-4-5-10-20(2,3)18-9-8-15-13-7-6-12-14(17-13)19-11-16-12/h6-7,11H,4-5,8-10H2,1-3H3,(H,15,17)
InChIKeyAEJMKOSFSGTEDU-UHFFFAOYSA-N
XLogP4.12
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.51
LogP ≤ 54.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine?
The IUPAC name of N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine (CID 90924340) is N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine.
What is the SMILES notation for N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine?
The canonical SMILES for N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine is CCCC[Si](C)(C)OCCNc1ccc2ncsc2n1.
What is the InChIKey of N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine?
The InChIKey is AEJMKOSFSGTEDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N3OSSi/c1-4-5-10-20(2,3)18-9-8-15-13-7-6-12-14(17-13)19-11-16-12/h6-7,11H,4-5,8-10H2,1-3H3,(H,15,17).
What are the key properties of N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine?
N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine has a molecular weight of 309.51 g/mol, XLogP of 4.12, 8 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[butyl(dimethyl)silyl]oxyethyl]-[1,3]thiazolo[5,4-b]pyridin-5-amine is sourced from PubChem (CID 90924340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).