6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol

C12H15N3OS — CID 136519670

IUPAC6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CN(C)Cc2nccs2)n1
InChIInChI=1S/C12H15N3OS/c1-9-3-4-11(16)10(14-9)7-15(2)8-12-13-5-6-17-12/h3-6,16H,7-8H2,1-2H3
InChIKeyCXAAPDQGLKGAMN-UHFFFAOYSA-N
MW249.34 g/mol
LogP2.18
Rot. Bonds4

About 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol

6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol (PubChem CID 136519670) has the molecular formula C12H15N3OS and a molecular weight of 249.34 g/mol. Its IUPAC name is 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol
PubChem CID136519670
Molecular FormulaC12H15N3OS
Molecular Weight249.34 g/mol
Exact Mass249.09
IUPAC Name6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol
SMILESCc1ccc(O)c(CN(C)Cc2nccs2)n1
InChIInChI=1S/C12H15N3OS/c1-9-3-4-11(16)10(14-9)7-15(2)8-12-13-5-6-17-12/h3-6,16H,7-8H2,1-2H3
InChIKeyCXAAPDQGLKGAMN-UHFFFAOYSA-N
XLogP2.18
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.34
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[(3-hydroxy-6-methyl-2-pyridinyl)methyl-methylamino]propanoic acid
CID 79158335
2-[[2-(2-ethoxyphenoxy)ethyl-methylamino]methyl]-6-methylpyridin-3-ol
CID 46996215
2-[[cyclopentyl(methyl)amino]methyl]-6-methylpyridin-3-ol
CID 82975195
6-methyl-2-[[propan-2-yl(propyl)amino]methyl]pyridin-3-ol
CID 82977420
2-[(3-hydroxy-6-methyl-2-pyridinyl)methyl-methylamino]propanoic acid
CID 79156630
ethyl 2-[methyl(1,3-thiazol-2-ylmethyl)amino]acetate
CID 79421858
2-[methyl(1,3-thiazol-2-ylmethyl)amino]acetonitrile
CID 79421779
6-methyl-2-[(methylideneamino)methyl]pyridin-3-ol
CID 143063225
2-[(3-hydroxy-6-methyl-2-pyridinyl)methyl-methylamino]-1-piperazin-1-ylethanone
CID 79156397
4-methoxy-N-methyl-N-(1,3-thiazol-2-ylmethyl)benzenesulfonamide
CID 110715752
N,7-dimethyl-4-oxo-N-(1,3-thiazol-2-ylmethyl)-1H-1,8-naphthyridine-3-carboxamide
CID 126788935
5-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]-1,3-thiazol-2-amine;hydrochloride
CID 120900861

Frequently Asked Questions

What is the IUPAC name of 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol?
The IUPAC name of 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol (CID 136519670) is 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol.
What is the SMILES notation for 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol?
The canonical SMILES for 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol is Cc1ccc(O)c(CN(C)Cc2nccs2)n1.
What is the InChIKey of 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol?
The InChIKey is CXAAPDQGLKGAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3OS/c1-9-3-4-11(16)10(14-9)7-15(2)8-12-13-5-6-17-12/h3-6,16H,7-8H2,1-2H3.
What are the key properties of 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol?
6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol has a molecular weight of 249.34 g/mol, XLogP of 2.18, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-2-[[methyl(1,3-thiazol-2-ylmethyl)amino]methyl]pyridin-3-ol is sourced from PubChem (CID 136519670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).