[4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol

C14H19N3O2S — CID 107510918

IUPAC[4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCOCc1nc(N(C)CCc2ccncc2)sc1CO
InChIInChI=1S/C14H19N3O2S/c1-17(8-5-11-3-6-15-7-4-11)14-16-12(10-19-2)13(9-18)20-14/h3-4,6-7,18H,5,8-10H2,1-2H3
InChIKeyHBWGTUXKKAPFCC-UHFFFAOYSA-N
MW293.39 g/mol
LogP1.86
Rot. Bonds7

About [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol

[4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol (PubChem CID 107510918) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol
PubChem CID107510918
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC Name[4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol
SMILESCOCc1nc(N(C)CCc2ccncc2)sc1CO
InChIInChI=1S/C14H19N3O2S/c1-17(8-5-11-3-6-15-7-4-11)14-16-12(10-19-2)13(9-18)20-14/h3-4,6-7,18H,5,8-10H2,1-2H3
InChIKeyHBWGTUXKKAPFCC-UHFFFAOYSA-N
XLogP1.86
TPSA58.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

[4-tert-butyl-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol
CID 62780337
[2-[(4-fluorophenyl)methyl-methylamino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
CID 107511017
[4-(methoxymethyl)-2-[methyl(2-methylbutyl)amino]-1,3-thiazol-5-yl]methanol
CID 107510895
[4-(methoxymethyl)-2-[methyl(propan-2-yl)amino]-1,3-thiazol-5-yl]methanol
CID 107510871
[2-[(3-fluorophenyl)methyl-methylamino]-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
CID 107510880
[2-(N,4-dimethylanilino)-4-(methoxymethyl)-1,3-thiazol-5-yl]methanol
CID 107510960
4-(methoxymethyl)-N-methyl-5-(methylaminomethyl)-N-(2-pyridin-2-ylethyl)-1,3-thiazol-2-amine
CID 107509600
[2-[ethyl(pyridin-4-ylmethyl)amino]-4-propyl-1,3-thiazol-5-yl]methanol
CID 62778496
2-N-methyl-2-N-(2-pyridin-4-ylethyl)-1,3,4-thiadiazole-2,5-diamine
CID 6917214
2-(methoxymethyl)-N,4-dimethyl-N-(2-pyridin-4-ylethyl)-1,3-thiazole-5-carboxamide
CID 110374824
[4-ethyl-2-[methyl(3-methylbutyl)amino]-1,3-thiazol-5-yl]methanol
CID 62778344
4-tert-butyl-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazole-5-carbaldehyde
CID 62765594

Frequently Asked Questions

What is the IUPAC name of [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
The IUPAC name of [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol (CID 107510918) is [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol is COCc1nc(N(C)CCc2ccncc2)sc1CO.
What is the InChIKey of [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
The InChIKey is HBWGTUXKKAPFCC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c1-17(8-5-11-3-6-15-7-4-11)14-16-12(10-19-2)13(9-18)20-14/h3-4,6-7,18H,5,8-10H2,1-2H3.
What are the key properties of [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol?
[4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol has a molecular weight of 293.39 g/mol, XLogP of 1.86, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(methoxymethyl)-2-[methyl(2-pyridin-4-ylethyl)amino]-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 107510918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).