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

C15H18N6 — CID 95343247

IUPAC2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile
SMILESCC(C)c1nc2n(n1)C[C@H](Nc1ncccc1C#N)CC2
InChIInChI=1S/C15H18N6/c1-10(2)14-19-13-6-5-12(9-21(13)20-14)18-15-11(8-16)4-3-7-17-15/h3-4,7,10,12H,5-6,9H2,1-2H3,(H,17,18)/t12-/m1/s1
InChIKeyITFZCPMXPZHZSD-GFCCVEGCSA-N
MW282.35 g/mol
LogP2.10
Rot. Bonds3

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

2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile (PubChem CID 95343247) has the molecular formula C15H18N6 and a molecular weight of 282.35 g/mol. Its IUPAC name is 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile
PubChem CID95343247
Molecular FormulaC15H18N6
Molecular Weight282.35 g/mol
Exact Mass282.16
IUPAC Name2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile
SMILESCC(C)c1nc2n(n1)C[C@H](Nc1ncccc1C#N)CC2
InChIInChI=1S/C15H18N6/c1-10(2)14-19-13-6-5-12(9-21(13)20-14)18-15-11(8-16)4-3-7-17-15/h3-4,7,10,12H,5-6,9H2,1-2H3,(H,17,18)/t12-/m1/s1
InChIKeyITFZCPMXPZHZSD-GFCCVEGCSA-N
XLogP2.10
TPSA79.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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

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Related Compounds

2-[[4-(methylamino)cyclohexyl]amino]pyridine-3-carbonitrile
CID 79110256
2-[(1-phenylpyrrolidin-3-yl)amino]pyridine-3-carbonitrile
CID 133292361
N-(4-ethylsulfonylphenyl)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 91651140
2-[(2-propan-2-yl-4,5,6,7-tetrahydroindazol-7-yl)amino]pyridine-3-carbonitrile
CID 75484155
2-[(3-methoxycyclopentyl)amino]pyridine-3-carbonitrile
CID 103081967
1-cyclobutyl-2-ethyl-3-(2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)guanidine;hydroiodide
CID 119154047
2-[(1-oxothian-4-yl)amino]pyridine-3-carbonitrile
CID 115886619
N-[6-methyl-2-(3-nitrophenyl)pyrimidin-4-yl]-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-amine
CID 133301843
2-[(3,3-dimethylcyclopentyl)amino]pyridine-3-carbonitrile
CID 115880942
2-[[1-(2,6-dimethylpyrimidin-4-yl)piperidin-4-yl]amino]pyridine-3-carbonitrile
CID 133336053
methyl 3-nitro-4-[(2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]benzoate
CID 119039007
2-[(2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)amino]-N-pyridin-3-ylacetamide
CID 56780086

Frequently Asked Questions

What is the IUPAC name of 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile?
The IUPAC name of 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile (CID 95343247) is 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile?
The canonical SMILES for 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile is CC(C)c1nc2n(n1)C[C@H](Nc1ncccc1C#N)CC2.
What is the InChIKey of 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile?
The InChIKey is ITFZCPMXPZHZSD-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H18N6/c1-10(2)14-19-13-6-5-12(9-21(13)20-14)18-15-11(8-16)4-3-7-17-15/h3-4,7,10,12H,5-6,9H2,1-2H3,(H,17,18)/t12-/m1/s1.
What are the key properties of 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile?
2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile has a molecular weight of 282.35 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(6R)-2-propan-2-yl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl]amino]pyridine-3-carbonitrile is sourced from PubChem (CID 95343247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).