3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile

C15H21N5 — CID 103468387

IUPAC3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile
SMILESN#Cc1nc(N2CCC(N3CCCCC3)C2)ccc1N
InChIInChI=1S/C15H21N5/c16-10-14-13(17)4-5-15(18-14)20-9-6-12(11-20)19-7-2-1-3-8-19/h4-5,12H,1-3,6-9,11,17H2
InChIKeyKETUOQPFTUCXPL-UHFFFAOYSA-N
MW271.37 g/mol
LogP1.60
Rot. Bonds2

About 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile

3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile (PubChem CID 103468387) has the molecular formula C15H21N5 and a molecular weight of 271.37 g/mol. Its IUPAC name is 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile
PubChem CID103468387
Molecular FormulaC15H21N5
Molecular Weight271.37 g/mol
Exact Mass271.18
IUPAC Name3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile
SMILESN#Cc1nc(N2CCC(N3CCCCC3)C2)ccc1N
InChIInChI=1S/C15H21N5/c16-10-14-13(17)4-5-15(18-14)20-9-6-12(11-20)19-7-2-1-3-8-19/h4-5,12H,1-3,6-9,11,17H2
InChIKeyKETUOQPFTUCXPL-UHFFFAOYSA-N
XLogP1.60
TPSA69.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.37
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

6-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)-3-chloropyridine-2-carbonitrile
CID 133305732
3-amino-6-[3-(hydroxymethyl)pyrrolidin-1-yl]pyridine-2-carbonitrile
CID 103468973
3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile
CID 103468676
3-amino-6-(3,5-dimethylpiperidin-1-yl)pyridine-2-carbonitrile
CID 103467207
2-[1-(5-amino-6-cyano-2-pyridinyl)piperidin-4-yl]acetamide
CID 103467985
6-(1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-2-yl)pyridine-2-carbonitrile
CID 78995478
1-[3-chloro-6-(3-piperidin-1-ylpyrrolidin-1-yl)-2-pyridinyl]-N-methylmethanamine
CID 63169284
2-(3-piperidin-1-ylpyrrolidin-1-yl)benzonitrile
CID 63512012
1-(5-amino-6-cyano-2-pyridinyl)piperidine-2-carboxamide
CID 103467973
3-amino-6-(1,1-dioxo-1,4-thiazepan-4-yl)pyridine-2-carbonitrile
CID 114083342
3-amino-6-(2-pyridin-4-ylpyrrolidin-1-yl)pyridine-2-carbonitrile
CID 103467643
6-(4-acetyl-1,4-diazepan-1-yl)-3-aminopyridine-2-carbonitrile
CID 103468030

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile?
The IUPAC name of 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile (CID 103468387) is 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile.
What is the SMILES notation for 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile?
The canonical SMILES for 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile is N#Cc1nc(N2CCC(N3CCCCC3)C2)ccc1N.
What is the InChIKey of 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile?
The InChIKey is KETUOQPFTUCXPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N5/c16-10-14-13(17)4-5-15(18-14)20-9-6-12(11-20)19-7-2-1-3-8-19/h4-5,12H,1-3,6-9,11,17H2.
What are the key properties of 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile?
3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile has a molecular weight of 271.37 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile is sourced from PubChem (CID 103468387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).