(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone

C14H19N5O2 — CID 43430927

IUPAC(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
SMILESCCc1c(C(=O)N2CCCC(CO)C2)cnc2ncnn12
InChIInChI=1S/C14H19N5O2/c1-2-12-11(6-15-14-16-9-17-19(12)14)13(21)18-5-3-4-10(7-18)8-20/h6,9-10,20H,2-5,7-8H2,1H3
InChIKeyHTINUCPPCLGGTI-UHFFFAOYSA-N
MW289.34 g/mol
LogP0.53
Rot. Bonds3

About (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone

(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone (PubChem CID 43430927) has the molecular formula C14H19N5O2 and a molecular weight of 289.34 g/mol. Its IUPAC name is (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
PubChem CID43430927
Molecular FormulaC14H19N5O2
Molecular Weight289.34 g/mol
Exact Mass289.15
IUPAC Name(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
SMILESCCc1c(C(=O)N2CCCC(CO)C2)cnc2ncnn12
InChIInChI=1S/C14H19N5O2/c1-2-12-11(6-15-14-16-9-17-19(12)14)13(21)18-5-3-4-10(7-18)8-20/h6,9-10,20H,2-5,7-8H2,1H3
InChIKeyHTINUCPPCLGGTI-UHFFFAOYSA-N
XLogP0.53
TPSA83.62 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 62370595
(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-(3-hydroxypiperidin-1-yl)methanone
CID 43428072
(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[2-(hydroxymethyl)piperidin-1-yl]methanone
CID 43430229
[5-ethyl-1-(4-fluorophenyl)pyrazol-4-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 110886741
(3R)-1-(7-methyl-[1,2,4]triazolo[1,5-a]pyrimidine-6-carbonyl)piperidine-3-carboxylic acid
CID 81127032
(2-ethyl-1,3-thiazol-5-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 110907783
(2-hydroxy-3-methylphenyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 43403219
(2,6-dimethyl-3-pyridinyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 61060891
(4-amino-5-ethyl-1H-pyrazol-3-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 62083228
[3-(hydroxymethyl)piperidin-1-yl]-(2-hydroxyphenyl)methanone
CID 43403148
[4-(1-cyclohexylethylamino)-1-ethylpyrazolo[3,4-b]pyridin-5-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 70239834
(3-chloro-4-pyridinyl)-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 66464424

Frequently Asked Questions

What is the IUPAC name of (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone?
The IUPAC name of (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone (CID 43430927) is (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone.
What is the SMILES notation for (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone?
The canonical SMILES for (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone is CCc1c(C(=O)N2CCCC(CO)C2)cnc2ncnn12.
What is the InChIKey of (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone?
The InChIKey is HTINUCPPCLGGTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N5O2/c1-2-12-11(6-15-14-16-9-17-19(12)14)13(21)18-5-3-4-10(7-18)8-20/h6,9-10,20H,2-5,7-8H2,1H3.
What are the key properties of (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone?
(7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone has a molecular weight of 289.34 g/mol, XLogP of 0.53, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-6-yl)-[3-(hydroxymethyl)piperidin-1-yl]methanone is sourced from PubChem (CID 43430927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).