[6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol

C14H12N4OS — CID 69231355

IUPAC[6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol
SMILESOCc1ccc(Nc2cccc(-c3nccs3)n2)nc1
InChIInChI=1S/C14H12N4OS/c19-9-10-4-5-12(16-8-10)18-13-3-1-2-11(17-13)14-15-6-7-20-14/h1-8,19H,9H2,(H,16,17,18)
InChIKeyQYWRDGUUZVYJDX-UHFFFAOYSA-N
MW284.34 g/mol
LogP2.84
Rot. Bonds4

About [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol

[6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol (PubChem CID 69231355) has the molecular formula C14H12N4OS and a molecular weight of 284.34 g/mol. Its IUPAC name is [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol.

Molecular Properties

Compound Name[6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol
PubChem CID69231355
Molecular FormulaC14H12N4OS
Molecular Weight284.34 g/mol
Exact Mass284.07
IUPAC Name[6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol
SMILESOCc1ccc(Nc2cccc(-c3nccs3)n2)nc1
InChIInChI=1S/C14H12N4OS/c19-9-10-4-5-12(16-8-10)18-13-3-1-2-11(17-13)14-15-6-7-20-14/h1-8,19H,9H2,(H,16,17,18)
InChIKeyQYWRDGUUZVYJDX-UHFFFAOYSA-N
XLogP2.84
TPSA70.93 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.34
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol?
The IUPAC name of [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol (CID 69231355) is [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol.
What is the SMILES notation for [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol?
The canonical SMILES for [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol is OCc1ccc(Nc2cccc(-c3nccs3)n2)nc1.
What is the InChIKey of [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol?
The InChIKey is QYWRDGUUZVYJDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N4OS/c19-9-10-4-5-12(16-8-10)18-13-3-1-2-11(17-13)14-15-6-7-20-14/h1-8,19H,9H2,(H,16,17,18).
What are the key properties of [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol?
[6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol has a molecular weight of 284.34 g/mol, XLogP of 2.84, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[[6-(1,3-thiazol-2-yl)-2-pyridinyl]amino]-3-pyridinyl]methanol is sourced from PubChem (CID 69231355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).