N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine

C14H13N3O2S — CID 69197119

IUPACN-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine
SMILESCOc1ccc(OC)c(Nc2cncc3scnc23)c1
InChIInChI=1S/C14H13N3O2S/c1-18-9-3-4-12(19-2)10(5-9)17-11-6-15-7-13-14(11)16-8-20-13/h3-8,17H,1-2H3
InChIKeyKGKONDXOXHXPRD-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.45
Rot. Bonds4

About N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine

N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine (PubChem CID 69197119) has the molecular formula C14H13N3O2S and a molecular weight of 287.34 g/mol. Its IUPAC name is N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine.

Molecular Properties

Compound NameN-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine
PubChem CID69197119
Molecular FormulaC14H13N3O2S
Molecular Weight287.34 g/mol
Exact Mass287.07
IUPAC NameN-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine
SMILESCOc1ccc(OC)c(Nc2cncc3scnc23)c1
InChIInChI=1S/C14H13N3O2S/c1-18-9-3-4-12(19-2)10(5-9)17-11-6-15-7-13-14(11)16-8-20-13/h3-8,17H,1-2H3
InChIKeyKGKONDXOXHXPRD-UHFFFAOYSA-N
XLogP3.45
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine?
The IUPAC name of N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine (CID 69197119) is N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine.
What is the SMILES notation for N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine?
The canonical SMILES for N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine is COc1ccc(OC)c(Nc2cncc3scnc23)c1.
What is the InChIKey of N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine?
The InChIKey is KGKONDXOXHXPRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3O2S/c1-18-9-3-4-12(19-2)10(5-9)17-11-6-15-7-13-14(11)16-8-20-13/h3-8,17H,1-2H3.
What are the key properties of N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine?
N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine has a molecular weight of 287.34 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethoxyphenyl)-[1,3]thiazolo[5,4-c]pyridin-7-amine is sourced from PubChem (CID 69197119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).