6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol

C12H15N3OS — CID 78943653

IUPAC6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CNCc2cnc(C)s2)n1
InChIInChI=1S/C12H15N3OS/c1-8-3-4-12(16)11(15-8)7-13-5-10-6-14-9(2)17-10/h3-4,6,13,16H,5,7H2,1-2H3
InChIKeyKZRDKBVMMQBDLJ-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.15
Rot. Bonds4

About 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol

6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol (PubChem CID 78943653) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol
PubChem CID78943653
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC Name6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CNCc2cnc(C)s2)n1
InChIInChI=1S/C12H15N3OS/c1-8-3-4-12(16)11(15-8)7-13-5-10-6-14-9(2)17-10/h3-4,6,13,16H,5,7H2,1-2H3
InChIKeyKZRDKBVMMQBDLJ-UHFFFAOYSA-N
XLogP2.15
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol with MolForge

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Related Compounds

2-[(but-2-ynylamino)methyl]-6-methylpyridin-3-ol
CID 115866294
6-methyl-2-[[(2-methylphenyl)methylamino]methyl]pyridin-3-ol
CID 78928537
2-[[(4-bromophenyl)methylamino]methyl]-6-methylpyridin-3-ol
CID 78928746
6-methyl-2-[[(5-methyl-1H-pyrazol-4-yl)methylamino]methyl]pyridin-3-ol
CID 79032588
2-[2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]phenyl]acetic acid
CID 115461723
2-[(2-methyl-1,3-thiazol-5-yl)methylamino]acetonitrile
CID 61280637
6-methyl-2-[(pent-3-ynylamino)methyl]pyridin-3-ol
CID 116643034
2-[(2-bromoprop-2-enylamino)methyl]-6-methylpyridin-3-ol
CID 115614759
2-[[(4-hydroxy-2-methylbutyl)amino]methyl]-6-methylpyridin-3-ol
CID 79033166
2-fluoro-6-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]phenol
CID 112606660
(2S)-1-[(2-methyl-1,3-thiazol-5-yl)methylamino]propan-2-ol
CID 93367091
1-[(2-methyl-1,3-thiazol-5-yl)methylamino]propan-2-ol
CID 60941890

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol?
The IUPAC name of 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol (CID 78943653) is 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol?
The canonical SMILES for 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol is Cc1ccc(O)c(CNCc2cnc(C)s2)n1.
What is the InChIKey of 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol?
The InChIKey is KZRDKBVMMQBDLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-8-3-4-12(16)11(15-8)7-13-5-10-6-14-9(2)17-10/h3-4,6,13,16H,5,7H2,1-2H3.
What are the key properties of 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol?
6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol has a molecular weight of 249.34 g/mol, XLogP of 2.15, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[[(2-methyl-1,3-thiazol-5-yl)methylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 78943653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).