6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile

C14H16N6O — CID 71918720

IUPAC6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile
SMILESCOCc1nc2n(n1)CCCC2Nc1ccc(C#N)cn1
InChIInChI=1S/C14H16N6O/c1-21-9-13-18-14-11(3-2-6-20(14)19-13)17-12-5-4-10(7-15)8-16-12/h4-5,8,11H,2-3,6,9H2,1H3,(H,16,17)
InChIKeySTPAHOALVOPVOH-UHFFFAOYSA-N
MW284.32 g/mol
LogP1.64
Rot. Bonds4

About 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile

6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile (PubChem CID 71918720) has the molecular formula C14H16N6O and a molecular weight of 284.32 g/mol. Its IUPAC name is 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile
PubChem CID71918720
Molecular FormulaC14H16N6O
Molecular Weight284.32 g/mol
Exact Mass284.14
IUPAC Name6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile
SMILESCOCc1nc2n(n1)CCCC2Nc1ccc(C#N)cn1
InChIInChI=1S/C14H16N6O/c1-21-9-13-18-14-11(3-2-6-20(14)19-13)17-12-5-4-10(7-15)8-16-12/h4-5,8,11H,2-3,6,9H2,1H3,(H,16,17)
InChIKeySTPAHOALVOPVOH-UHFFFAOYSA-N
XLogP1.64
TPSA88.65 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile?
The IUPAC name of 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile (CID 71918720) is 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile?
The canonical SMILES for 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile is COCc1nc2n(n1)CCCC2Nc1ccc(C#N)cn1.
What is the InChIKey of 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile?
The InChIKey is STPAHOALVOPVOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N6O/c1-21-9-13-18-14-11(3-2-6-20(14)19-13)17-12-5-4-10(7-15)8-16-12/h4-5,8,11H,2-3,6,9H2,1H3,(H,16,17).
What are the key properties of 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile?
6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile has a molecular weight of 284.32 g/mol, XLogP of 1.64, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[2-(methoxymethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-8-yl]amino]pyridine-3-carbonitrile is sourced from PubChem (CID 71918720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).