3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile

C13H19N5 — CID 103468676

IUPAC3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile
SMILESCN(C)C1CCCN(c2ccc(N)c(C#N)n2)C1
InChIInChI=1S/C13H19N5/c1-17(2)10-4-3-7-18(9-10)13-6-5-11(15)12(8-14)16-13/h5-6,10H,3-4,7,9,15H2,1-2H3
InChIKeyNALIFZFCDQRRMY-UHFFFAOYSA-N
MW245.33 g/mol
LogP1.07
Rot. Bonds2

About 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile

3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile (PubChem CID 103468676) has the molecular formula C13H19N5 and a molecular weight of 245.33 g/mol. Its IUPAC name is 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile.

Molecular Properties

Compound Name3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile
PubChem CID103468676
Molecular FormulaC13H19N5
Molecular Weight245.33 g/mol
Exact Mass245.16
IUPAC Name3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile
SMILESCN(C)C1CCCN(c2ccc(N)c(C#N)n2)C1
InChIInChI=1S/C13H19N5/c1-17(2)10-4-3-7-18(9-10)13-6-5-11(15)12(8-14)16-13/h5-6,10H,3-4,7,9,15H2,1-2H3
InChIKeyNALIFZFCDQRRMY-UHFFFAOYSA-N
XLogP1.07
TPSA69.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.33
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-amino-6-(3-piperidin-1-ylpyrrolidin-1-yl)pyridine-2-carbonitrile
CID 103468387
4-[3-(dimethylamino)piperidin-1-yl]pyrimidin-2-amine
CID 80856327
3-amino-6-[3-(hydroxymethyl)pyrrolidin-1-yl]pyridine-2-carbonitrile
CID 103468973
3-amino-6-(3,5-dimethylpiperidin-1-yl)pyridine-2-carbonitrile
CID 103467207
6-(4-acetyl-1,4-diazepan-1-yl)-3-aminopyridine-2-carbonitrile
CID 103468030
6-[(3S)-3-(dimethylamino)pyrrolidin-1-yl]pyridazine-3-carbonitrile
CID 145425808
1-[6-(aminomethyl)pyrazin-2-yl]-N,N-dimethylpiperidin-3-amine
CID 66449162
3-amino-6-(1,1-dioxo-1,4-thiazepan-4-yl)pyridine-2-carbonitrile
CID 114083342
6-[3-(dimethylamino)piperidin-1-yl]pyrimidin-4-amine
CID 80856163
4-[3-(dimethylamino)piperidin-1-yl]-6-methoxypyrimidin-2-amine
CID 45184702
3-amino-6-(2-pyridin-4-ylpyrrolidin-1-yl)pyridine-2-carbonitrile
CID 103467643
6-[4-(dimethylamino)piperidin-1-yl]pyridine-2,3-diamine
CID 67292538

Frequently Asked Questions

What is the IUPAC name of 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile?
The IUPAC name of 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile (CID 103468676) is 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile.
What is the SMILES notation for 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile?
The canonical SMILES for 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile is CN(C)C1CCCN(c2ccc(N)c(C#N)n2)C1.
What is the InChIKey of 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile?
The InChIKey is NALIFZFCDQRRMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N5/c1-17(2)10-4-3-7-18(9-10)13-6-5-11(15)12(8-14)16-13/h5-6,10H,3-4,7,9,15H2,1-2H3.
What are the key properties of 3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile?
3-amino-6-[3-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile has a molecular weight of 245.33 g/mol, XLogP of 1.07, 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-(dimethylamino)piperidin-1-yl]pyridine-2-carbonitrile is sourced from PubChem (CID 103468676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).