(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol

C15H15N3OS — CID 155550854

IUPAC(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol
SMILESCc1cc(C)c2c(N)c(C(O)c3ccncc3)sc2n1
InChIInChI=1S/C15H15N3OS/c1-8-7-9(2)18-15-11(8)12(16)14(20-15)13(19)10-3-5-17-6-4-10/h3-7,13,19H,16H2,1-2H3
InChIKeyNBKYNQXJQOYCAD-UHFFFAOYSA-N
MW285.37 g/mol
LogP2.97
Rot. Bonds2

About (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol

(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol (PubChem CID 155550854) has the molecular formula C15H15N3OS and a molecular weight of 285.37 g/mol. Its IUPAC name is (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol.

Molecular Properties

Compound Name(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol
PubChem CID155550854
Molecular FormulaC15H15N3OS
Molecular Weight285.37 g/mol
Exact Mass285.09
IUPAC Name(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol
SMILESCc1cc(C)c2c(N)c(C(O)c3ccncc3)sc2n1
InChIInChI=1S/C15H15N3OS/c1-8-7-9(2)18-15-11(8)12(16)14(20-15)13(19)10-3-5-17-6-4-10/h3-7,13,19H,16H2,1-2H3
InChIKeyNBKYNQXJQOYCAD-UHFFFAOYSA-N
XLogP2.97
TPSA72.03 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.37
LogP ≤ 52.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol?
The IUPAC name of (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol (CID 155550854) is (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol.
What is the SMILES notation for (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol?
The canonical SMILES for (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol is Cc1cc(C)c2c(N)c(C(O)c3ccncc3)sc2n1.
What is the InChIKey of (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol?
The InChIKey is NBKYNQXJQOYCAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N3OS/c1-8-7-9(2)18-15-11(8)12(16)14(20-15)13(19)10-3-5-17-6-4-10/h3-7,13,19H,16H2,1-2H3.
What are the key properties of (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol?
(3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol has a molecular weight of 285.37 g/mol, XLogP of 2.97, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3-amino-4,6-dimethylthieno[2,3-b]pyridin-2-yl)-pyridin-4-ylmethanol is sourced from PubChem (CID 155550854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).