5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol

C14H19N3O2S — CID 116686503

IUPAC5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol
SMILESCc1cnc(C(C)NCc2c(CO)cnc(C)c2O)s1
InChIInChI=1S/C14H19N3O2S/c1-8-4-17-14(20-8)10(3)16-6-12-11(7-18)5-15-9(2)13(12)19/h4-5,10,16,18-19H,6-7H2,1-3H3
InChIKeyFAUNNCMOVLHOMU-UHFFFAOYSA-N
MW293.39 g/mol
LogP2.20
Rot. Bonds5

About 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol

5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol (PubChem CID 116686503) has the molecular formula C14H19N3O2S and a molecular weight of 293.39 g/mol. Its IUPAC name is 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol.

Molecular Properties

Compound Name5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol
PubChem CID116686503
Molecular FormulaC14H19N3O2S
Molecular Weight293.39 g/mol
Exact Mass293.12
IUPAC Name5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol
SMILESCc1cnc(C(C)NCc2c(CO)cnc(C)c2O)s1
InChIInChI=1S/C14H19N3O2S/c1-8-4-17-14(20-8)10(3)16-6-12-11(7-18)5-15-9(2)13(12)19/h4-5,10,16,18-19H,6-7H2,1-3H3
InChIKeyFAUNNCMOVLHOMU-UHFFFAOYSA-N
XLogP2.20
TPSA78.27 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.39
LogP ≤ 52.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Analyze 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol with MolForge

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Related Compounds

2-[3-Hydroxy-5-(hydroxymethyl)-2-methylpyridin-4-yl]-1,3-thiazolidine-4-carboxylic acid
CID 353316
5-[(4-Tert-butyl-1,3-thiazol-2-yl)sulfanylmethyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol
CID 2805118
(2-DL)-2-(3-Hydroxy-5-hydroxymethyl-2-methyl-4-pyridyl)thiazolidine
CID 353315
[5-Hydroxy-6-methyl-4-(1,3-thiazolidin-2-yl)-3-pyridinyl]methyl dihydrogen phosphate
CID 342677
5-(Hydroxymethyl)-4-((isopropylamino)methyl)-2-methylpyridin-3-ol
CID 112704290
5-[(4,5-Dimethyl-1,3-thiazol-3-ium-3-yl)methyl]-4-(hydroxymethyl)-2-methylpyridin-3-ol chloride
CID 12332451
5-(Hydroxymethyl)-2-methyl-4-(4-methylimidazolidin-2-yl)pyridin-3-ol
CID 156579829
Methyl 2-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]-1,3-thiazolidine-4-carboxylate
CID 353742
4-(6,7-dihydro-4H-[1,3]thiazolo[5,4-d]oxazin-7-yl)-5-(hydroxymethyl)-2-methylpyridin-3-ol;hydrochloride
CID 24192683
4-({Cyclopropyl[(3-methyl-2-thienyl)methyl]amino}methyl)-5-(hydroxymethyl)-2-methylpyridin-3-ol
CID 56701991
5-(hydroxymethyl)-2-methyl-4-[(E)-[(5-methyl-1,3-thiazol-2-yl)hydrazinylidene]methyl]pyridin-3-ol;hydrochloride
CID 135502374
(4R)-2-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]-1,3-thiazolidine-4-carboxylic acid
CID 9795418

Frequently Asked Questions

What is the IUPAC name of 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol?
The IUPAC name of 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol (CID 116686503) is 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol.
What is the SMILES notation for 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol?
The canonical SMILES for 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol is Cc1cnc(C(C)NCc2c(CO)cnc(C)c2O)s1.
What is the InChIKey of 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol?
The InChIKey is FAUNNCMOVLHOMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2S/c1-8-4-17-14(20-8)10(3)16-6-12-11(7-18)5-15-9(2)13(12)19/h4-5,10,16,18-19H,6-7H2,1-3H3.
What are the key properties of 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol?
5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol has a molecular weight of 293.39 g/mol, XLogP of 2.20, 5 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(hydroxymethyl)-2-methyl-4-[[1-(5-methyl-1,3-thiazol-2-yl)ethylamino]methyl]pyridin-3-ol is sourced from PubChem (CID 116686503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).