5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile

C10H15N5 — CID 83856508

IUPAC5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile
SMILESCn1nc(C2CCCCN2)c(C#N)c1N
InChIInChI=1S/C10H15N5/c1-15-10(12)7(6-11)9(14-15)8-4-2-3-5-13-8/h8,13H,2-5,12H2,1H3
InChIKeyHZLGLNLRHCZPDL-UHFFFAOYSA-N
MW205.26 g/mol
LogP0.69
Rot. Bonds1

About 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile

5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile (PubChem CID 83856508) has the molecular formula C10H15N5 and a molecular weight of 205.26 g/mol. Its IUPAC name is 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile.

Molecular Properties

Compound Name5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile
PubChem CID83856508
Molecular FormulaC10H15N5
Molecular Weight205.26 g/mol
Exact Mass205.13
IUPAC Name5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile
SMILESCn1nc(C2CCCCN2)c(C#N)c1N
InChIInChI=1S/C10H15N5/c1-15-10(12)7(6-11)9(14-15)8-4-2-3-5-13-8/h8,13H,2-5,12H2,1H3
InChIKeyHZLGLNLRHCZPDL-UHFFFAOYSA-N
XLogP0.69
TPSA79.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.26
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-5-[(2S)-piperidin-2-yl]-1,2,4-triazol-3-amine
CID 104915236
4-fluoro-1,5-dimethyl-3-pyrrolidin-2-ylpyrazole
CID 89231145
5-amino-3-(1,4-diazepan-1-yl)-1-methylpyrazole-4-carbonitrile
CID 102795417
2-(4-methyl-1,2,4-triazol-3-yl)piperidine
CID 62406028
2-(4-methyl-1,2,4-triazol-3-yl)azepane
CID 64562303
5-methoxy-1-methyl-3-piperidin-2-ylindazole
CID 82622650
2-(2,5-dimethyl-1,2,4-triazol-3-yl)azepane
CID 64562693
1-methyl-4-pyrrolidin-2-ylpyrazol-5-amine
CID 163948603
5-amino-3-(1-cyclopropylethylamino)-1-methylpyrazole-4-carbonitrile
CID 102795442
5-cyclopentyl-2,4-dimethylpyrazol-3-amine
CID 43158729
2,5-dimethyl-4-piperidin-2-yl-1,3-thiazole
CID 82399301
2-(5-ethyl-2-methyl-1,2,4-triazol-3-yl)piperidine
CID 62721773

Frequently Asked Questions

What is the IUPAC name of 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile?
The IUPAC name of 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile (CID 83856508) is 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile.
What is the SMILES notation for 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile?
The canonical SMILES for 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile is Cn1nc(C2CCCCN2)c(C#N)c1N.
What is the InChIKey of 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile?
The InChIKey is HZLGLNLRHCZPDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5/c1-15-10(12)7(6-11)9(14-15)8-4-2-3-5-13-8/h8,13H,2-5,12H2,1H3.
What are the key properties of 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile?
5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile has a molecular weight of 205.26 g/mol, XLogP of 0.69, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-1-methyl-3-piperidin-2-ylpyrazole-4-carbonitrile is sourced from PubChem (CID 83856508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).