[2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol

C14H24N4O — CID 117156369

IUPAC[2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol
SMILESOCC1CCn2nc(CCN3CCCCC3)nc2C1
InChIInChI=1S/C14H24N4O/c19-11-12-4-9-18-14(10-12)15-13(16-18)5-8-17-6-2-1-3-7-17/h12,19H,1-11H2
InChIKeyMVKSIBLPTCPHQF-UHFFFAOYSA-N
MW264.37 g/mol
LogP0.86
Rot. Bonds4

About [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol

[2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol (PubChem CID 117156369) has the molecular formula C14H24N4O and a molecular weight of 264.37 g/mol. Its IUPAC name is [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol.

Molecular Properties

Compound Name[2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol
PubChem CID117156369
Molecular FormulaC14H24N4O
Molecular Weight264.37 g/mol
Exact Mass264.20
IUPAC Name[2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol
SMILESOCC1CCn2nc(CCN3CCCCC3)nc2C1
InChIInChI=1S/C14H24N4O/c19-11-12-4-9-18-14(10-12)15-13(16-18)5-8-17-6-2-1-3-7-17/h12,19H,1-11H2
InChIKeyMVKSIBLPTCPHQF-UHFFFAOYSA-N
XLogP0.86
TPSA54.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 50.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol?
The IUPAC name of [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol (CID 117156369) is [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol.
What is the SMILES notation for [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol?
The canonical SMILES for [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol is OCC1CCn2nc(CCN3CCCCC3)nc2C1.
What is the InChIKey of [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol?
The InChIKey is MVKSIBLPTCPHQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4O/c19-11-12-4-9-18-14(10-12)15-13(16-18)5-8-17-6-2-1-3-7-17/h12,19H,1-11H2.
What are the key properties of [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol?
[2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol has a molecular weight of 264.37 g/mol, XLogP of 0.86, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-piperidin-1-ylethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-yl]methanol is sourced from PubChem (CID 117156369), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).