[6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol

C15H13N3OS — CID 18506891

IUPAC[6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol
SMILESOCc1cccc(Nc2ncc(-c3ccccc3)s2)n1
InChIInChI=1S/C15H13N3OS/c19-10-12-7-4-8-14(17-12)18-15-16-9-13(20-15)11-5-2-1-3-6-11/h1-9,19H,10H2,(H,16,17,18)
InChIKeyFVTPIEHQEQYHIL-UHFFFAOYSA-N
MW283.36 g/mol
LogP3.44
Rot. Bonds4

About [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol

[6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol (PubChem CID 18506891) has the molecular formula C15H13N3OS and a molecular weight of 283.36 g/mol. Its IUPAC name is [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol
PubChem CID18506891
Molecular FormulaC15H13N3OS
Molecular Weight283.36 g/mol
Exact Mass283.08
IUPAC Name[6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol
SMILESOCc1cccc(Nc2ncc(-c3ccccc3)s2)n1
InChIInChI=1S/C15H13N3OS/c19-10-12-7-4-8-14(17-12)18-15-16-9-13(20-15)11-5-2-1-3-6-11/h1-9,19H,10H2,(H,16,17,18)
InChIKeyFVTPIEHQEQYHIL-UHFFFAOYSA-N
XLogP3.44
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.36
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol?
The IUPAC name of [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol (CID 18506891) is [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol.
What is the SMILES notation for [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol?
The canonical SMILES for [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol is OCc1cccc(Nc2ncc(-c3ccccc3)s2)n1.
What is the InChIKey of [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol?
The InChIKey is FVTPIEHQEQYHIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3OS/c19-10-12-7-4-8-14(17-12)18-15-16-9-13(20-15)11-5-2-1-3-6-11/h1-9,19H,10H2,(H,16,17,18).
What are the key properties of [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol?
[6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol has a molecular weight of 283.36 g/mol, XLogP of 3.44, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[(5-phenyl-1,3-thiazol-2-yl)amino]-2-pyridinyl]methanol is sourced from PubChem (CID 18506891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).