7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine

C15H14FN3OS — CID 134211811

IUPAC7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine
SMILESCOC(c1ccc(F)cc1)c1c(N)cnc2sc(C)nc12
InChIInChI=1S/C15H14FN3OS/c1-8-19-13-12(11(17)7-18-15(13)21-8)14(20-2)9-3-5-10(16)6-4-9/h3-7,14H,17H2,1-2H3
InChIKeyKQUJUAADHSQEHV-UHFFFAOYSA-N
MW303.36 g/mol
LogP3.46
Rot. Bonds3

About 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine

7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine (PubChem CID 134211811) has the molecular formula C15H14FN3OS and a molecular weight of 303.36 g/mol. Its IUPAC name is 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine.

Molecular Properties

Compound Name7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine
PubChem CID134211811
Molecular FormulaC15H14FN3OS
Molecular Weight303.36 g/mol
Exact Mass303.08
IUPAC Name7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine
SMILESCOC(c1ccc(F)cc1)c1c(N)cnc2sc(C)nc12
InChIInChI=1S/C15H14FN3OS/c1-8-19-13-12(11(17)7-18-15(13)21-8)14(20-2)9-3-5-10(16)6-4-9/h3-7,14H,17H2,1-2H3
InChIKeyKQUJUAADHSQEHV-UHFFFAOYSA-N
XLogP3.46
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.36
LogP ≤ 53.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine?
The IUPAC name of 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine (CID 134211811) is 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine.
What is the SMILES notation for 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine?
The canonical SMILES for 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine is COC(c1ccc(F)cc1)c1c(N)cnc2sc(C)nc12.
What is the InChIKey of 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine?
The InChIKey is KQUJUAADHSQEHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3OS/c1-8-19-13-12(11(17)7-18-15(13)21-8)14(20-2)9-3-5-10(16)6-4-9/h3-7,14H,17H2,1-2H3.
What are the key properties of 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine?
7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine has a molecular weight of 303.36 g/mol, XLogP of 3.46, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(4-fluorophenyl)-methoxymethyl]-2-methyl-[1,3]thiazolo[5,4-b]pyridin-6-amine is sourced from PubChem (CID 134211811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).