[1-(piperidin-4-ylmethyl)triazol-4-yl]methanol

C9H16N4O — CID 86262272

IUPAC[1-(piperidin-4-ylmethyl)triazol-4-yl]methanol
SMILESOCc1cn(CC2CCNCC2)nn1
InChIInChI=1S/C9H16N4O/c14-7-9-6-13(12-11-9)5-8-1-3-10-4-2-8/h6,8,10,14H,1-5,7H2
InChIKeyUTRKVENMMIAPFK-UHFFFAOYSA-N
MW196.25 g/mol
LogP-0.23
Rot. Bonds3

About [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol

[1-(piperidin-4-ylmethyl)triazol-4-yl]methanol (PubChem CID 86262272) has the molecular formula C9H16N4O and a molecular weight of 196.25 g/mol. Its IUPAC name is [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol.

Molecular Properties

Compound Name[1-(piperidin-4-ylmethyl)triazol-4-yl]methanol
PubChem CID86262272
Molecular FormulaC9H16N4O
Molecular Weight196.25 g/mol
Exact Mass196.13
IUPAC Name[1-(piperidin-4-ylmethyl)triazol-4-yl]methanol
SMILESOCc1cn(CC2CCNCC2)nn1
InChIInChI=1S/C9H16N4O/c14-7-9-6-13(12-11-9)5-8-1-3-10-4-2-8/h6,8,10,14H,1-5,7H2
InChIKeyUTRKVENMMIAPFK-UHFFFAOYSA-N
XLogP-0.23
TPSA62.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol 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

[1-(piperidin-4-ylmethyl)triazol-4-yl]methanamine
CID 121208781
[1-(oxolan-3-ylmethyl)triazol-4-yl]methanol
CID 62400526
(1-piperidin-4-yltriazol-4-yl)methanol;hydrochloride
CID 86262656
[1-[[1-(5-methylhexan-2-yl)piperidin-4-yl]methyl]triazol-4-yl]methanol
CID 46993018
cycloheptyl-[4-[[4-(hydroxymethyl)triazol-1-yl]methyl]piperidin-1-yl]methanone
CID 46986620
methyl 1-(piperidin-4-ylmethyl)triazole-4-carboxylate
CID 115034482
1-[4-[[4-(hydroxymethyl)triazol-1-yl]methyl]piperidin-1-yl]-2-(4-hydroxyphenyl)ethanone
CID 31193716
1-[(3S)-3-[[4-(hydroxymethyl)triazol-1-yl]methyl]pyrrolidin-1-yl]ethanone
CID 129495741
[1-[(5-methyloxolan-2-yl)methyl]triazol-4-yl]methanol
CID 103138035
4-(bromomethyl)-1-(cyclopentylmethyl)triazole
CID 62400118
4-(bromomethyl)-1-(oxan-4-ylmethyl)triazole
CID 62402137
4-(chloromethyl)-1-(oxan-4-ylmethyl)triazole
CID 62399510

Frequently Asked Questions

What is the IUPAC name of [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol?
The IUPAC name of [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol (CID 86262272) is [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol.
What is the SMILES notation for [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol?
The canonical SMILES for [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol is OCc1cn(CC2CCNCC2)nn1.
What is the InChIKey of [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol?
The InChIKey is UTRKVENMMIAPFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N4O/c14-7-9-6-13(12-11-9)5-8-1-3-10-4-2-8/h6,8,10,14H,1-5,7H2.
What are the key properties of [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol?
[1-(piperidin-4-ylmethyl)triazol-4-yl]methanol has a molecular weight of 196.25 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(piperidin-4-ylmethyl)triazol-4-yl]methanol is sourced from PubChem (CID 86262272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).