2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile

C19H20N6 — CID 84599190

IUPAC2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile
SMILESCc1cccc(NC2CCN(c3nc4ccccn4c3C#N)CC2)n1
InChIInChI=1S/C19H20N6/c1-14-5-4-6-17(21-14)22-15-8-11-24(12-9-15)19-16(13-20)25-10-3-2-7-18(25)23-19/h2-7,10,15H,8-9,11-12H2,1H3,(H,21,22)
InChIKeyKACLGDZRWXMIAF-UHFFFAOYSA-N
MW332.41 g/mol
LogP2.99
Rot. Bonds3

About 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile

2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile (PubChem CID 84599190) has the molecular formula C19H20N6 and a molecular weight of 332.41 g/mol. Its IUPAC name is 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile
PubChem CID84599190
Molecular FormulaC19H20N6
Molecular Weight332.41 g/mol
Exact Mass332.17
IUPAC Name2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile
SMILESCc1cccc(NC2CCN(c3nc4ccccn4c3C#N)CC2)n1
InChIInChI=1S/C19H20N6/c1-14-5-4-6-17(21-14)22-15-8-11-24(12-9-15)19-16(13-20)25-10-3-2-7-18(25)23-19/h2-7,10,15H,8-9,11-12H2,1H3,(H,21,22)
InChIKeyKACLGDZRWXMIAF-UHFFFAOYSA-N
XLogP2.99
TPSA69.25 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
The IUPAC name of 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile (CID 84599190) is 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile.
What is the SMILES notation for 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
The canonical SMILES for 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile is Cc1cccc(NC2CCN(c3nc4ccccn4c3C#N)CC2)n1.
What is the InChIKey of 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
The InChIKey is KACLGDZRWXMIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6/c1-14-5-4-6-17(21-14)22-15-8-11-24(12-9-15)19-16(13-20)25-10-3-2-7-18(25)23-19/h2-7,10,15H,8-9,11-12H2,1H3,(H,21,22).
What are the key properties of 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile?
2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile has a molecular weight of 332.41 g/mol, XLogP of 2.99, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[(6-methyl-2-pyridinyl)amino]piperidin-1-yl]imidazo[1,2-a]pyridine-3-carbonitrile is sourced from PubChem (CID 84599190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).