6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile

C12H11N5 — CID 166214209

IUPAC6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(N2CCn3cncc3C2)nc1
InChIInChI=1S/C12H11N5/c13-5-10-1-2-12(15-6-10)16-3-4-17-9-14-7-11(17)8-16/h1-2,6-7,9H,3-4,8H2
InChIKeyLVULFMIHTJVUEC-UHFFFAOYSA-N
MW225.26 g/mol
LogP1.17
Rot. Bonds1

About 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile

6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile (PubChem CID 166214209) has the molecular formula C12H11N5 and a molecular weight of 225.26 g/mol. Its IUPAC name is 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile.

Molecular Properties

Compound Name6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile
PubChem CID166214209
Molecular FormulaC12H11N5
Molecular Weight225.26 g/mol
Exact Mass225.10
IUPAC Name6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile
SMILESN#Cc1ccc(N2CCn3cncc3C2)nc1
InChIInChI=1S/C12H11N5/c13-5-10-1-2-12(15-6-10)16-3-4-17-9-14-7-11(17)8-16/h1-2,6-7,9H,3-4,8H2
InChIKeyLVULFMIHTJVUEC-UHFFFAOYSA-N
XLogP1.17
TPSA57.74 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

7-(2-chloropyrimidin-4-yl)-6,8-dihydro-5H-imidazo[1,5-a]pyrazine
CID 22308315
6-[4-(5-nitro-2-pyridinyl)piperazin-1-yl]pyridine-3-carbonitrile
CID 133271157
6-[4-(6-cyclopropylpyrimidin-4-yl)piperazin-1-yl]pyridine-3-carbonitrile
CID 139023243
6-(3-propan-2-ylpyrrolidin-1-yl)pyridine-3-carbonitrile
CID 112698394
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-(9-cyclopropylpurin-6-yl)piperazin-1-yl]pyridine-3-carbonitrile
CID 155980578
6-[4-[[3-(trifluoromethyl)pyrazol-1-yl]methyl]piperazin-1-yl]pyridine-3-carbonitrile
CID 56821476
6-[[(6S)-8-pyrimidin-2-yl-5,6,7,9-tetrahydroimidazo[1,5-a][1,4]diazepin-6-yl]methoxy]pyridine-3-carbonitrile
CID 97476153
6-[4-(5-cyano-2-pyridinyl)piperazin-1-yl]pyridine-2-carboxylic acid
CID 122047879
6-[4-(5-nitropyrimidin-2-yl)piperazin-1-yl]pyridine-3-carbonitrile
CID 154640969
6-[4-(3-hydroxypropanoyl)piperazin-1-yl]pyridine-3-carbonitrile
CID 153358087

Frequently Asked Questions

What is the IUPAC name of 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile?
The IUPAC name of 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile (CID 166214209) is 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile?
The canonical SMILES for 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile is N#Cc1ccc(N2CCn3cncc3C2)nc1.
What is the InChIKey of 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile?
The InChIKey is LVULFMIHTJVUEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N5/c13-5-10-1-2-12(15-6-10)16-3-4-17-9-14-7-11(17)8-16/h1-2,6-7,9H,3-4,8H2.
What are the key properties of 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile?
6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile has a molecular weight of 225.26 g/mol, XLogP of 1.17, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6,8-dihydro-5H-imidazo[1,5-a]pyrazin-7-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 166214209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).