6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile

C17H20N6 — CID 133469882

IUPAC6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
SMILESCc1cnc(C)c(NC2CCN(c3ccc(C#N)cn3)CC2)n1
InChIInChI=1S/C17H20N6/c1-12-10-19-13(2)17(21-12)22-15-5-7-23(8-6-15)16-4-3-14(9-18)11-20-16/h3-4,10-11,15H,5-8H2,1-2H3,(H,21,22)
InChIKeyARJNSTSOTFKJAB-UHFFFAOYSA-N
MW308.39 g/mol
LogP2.44
Rot. Bonds3

About 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile

6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile (PubChem CID 133469882) has the molecular formula C17H20N6 and a molecular weight of 308.39 g/mol. Its IUPAC name is 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
PubChem CID133469882
Molecular FormulaC17H20N6
Molecular Weight308.39 g/mol
Exact Mass308.17
IUPAC Name6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
SMILESCc1cnc(C)c(NC2CCN(c3ccc(C#N)cn3)CC2)n1
InChIInChI=1S/C17H20N6/c1-12-10-19-13(2)17(21-12)22-15-5-7-23(8-6-15)16-4-3-14(9-18)11-20-16/h3-4,10-11,15H,5-8H2,1-2H3,(H,21,22)
InChIKeyARJNSTSOTFKJAB-UHFFFAOYSA-N
XLogP2.44
TPSA77.73 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.39
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3,6-dimethyl-N-[1-(6-methyl-2-pyridinyl)piperidin-4-yl]pyrazin-2-amine
CID 133471381
6-[4-(6-methylpyrazin-2-yl)oxypiperidin-1-yl]pyridine-3-carbonitrile
CID 171701933
6-[4-(quinolin-2-ylamino)piperidin-1-yl]pyridine-3-carbonitrile
CID 133286840
6-[4-[(4-methoxypyrimidin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 133286804
6-(4-propan-2-ylpiperidin-1-yl)pyridine-3-carbonitrile
CID 58431342
6-[4-(dimethylamino)piperidin-1-yl]pyridine-3-carbonitrile
CID 43430337
6-[4-[(2-pyridin-4-ylquinazolin-4-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 133286769
6-[4-[(2-methylphenyl)methylamino]piperidin-1-yl]pyridine-3-carbonitrile
CID 119110757
6-[4-[(6-methyl-2-pyridinyl)oxymethyl]piperidin-1-yl]pyridine-3-carbonitrile
CID 126875911
6-[4-(3-methyl-4-nitroanilino)piperidin-1-yl]pyridine-3-carbonitrile
CID 133286761
6-(4-methylazepan-1-yl)pyridine-3-carbonitrile
CID 62045126
6-[4-[(5-nitroimidazo[2,1-b][1,3]thiazol-6-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile
CID 133286798

Frequently Asked Questions

What is the IUPAC name of 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile?
The IUPAC name of 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile (CID 133469882) is 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile?
The canonical SMILES for 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile is Cc1cnc(C)c(NC2CCN(c3ccc(C#N)cn3)CC2)n1.
What is the InChIKey of 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile?
The InChIKey is ARJNSTSOTFKJAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6/c1-12-10-19-13(2)17(21-12)22-15-5-7-23(8-6-15)16-4-3-14(9-18)11-20-16/h3-4,10-11,15H,5-8H2,1-2H3,(H,21,22).
What are the key properties of 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile?
6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile has a molecular weight of 308.39 g/mol, XLogP of 2.44, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[(3,6-dimethylpyrazin-2-yl)amino]piperidin-1-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 133469882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).