2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine

C17H19N7 — CID 110253590

IUPAC2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine
SMILESCc1cc(N2CCCC(c3cncc(-n4ccnc4)n3)C2)ncn1
InChIInChI=1S/C17H19N7/c1-13-7-16(21-11-20-13)23-5-2-3-14(10-23)15-8-19-9-17(22-15)24-6-4-18-12-24/h4,6-9,11-12,14H,2-3,5,10H2,1H3
InChIKeyQCIIAYHGUMIVQE-UHFFFAOYSA-N
MW321.39 g/mol
LogP2.14
Rot. Bonds3

About 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine

2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine (PubChem CID 110253590) has the molecular formula C17H19N7 and a molecular weight of 321.39 g/mol. Its IUPAC name is 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine.

Molecular Properties

Compound Name2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine
PubChem CID110253590
Molecular FormulaC17H19N7
Molecular Weight321.39 g/mol
Exact Mass321.17
IUPAC Name2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine
SMILESCc1cc(N2CCCC(c3cncc(-n4ccnc4)n3)C2)ncn1
InChIInChI=1S/C17H19N7/c1-13-7-16(21-11-20-13)23-5-2-3-14(10-23)15-8-19-9-17(22-15)24-6-4-18-12-24/h4,6-9,11-12,14H,2-3,5,10H2,1H3
InChIKeyQCIIAYHGUMIVQE-UHFFFAOYSA-N
XLogP2.14
TPSA72.62 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.39
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Analyze 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-imidazol-1-yl-6-[(3S)-1-pyrimidin-2-ylpiperidin-3-yl]pyrazine
CID 95815844
2-[(3R)-3-(6-imidazol-1-yl-2-pyridinyl)piperidin-1-yl]-4,6-dimethylpyrimidine
CID 95829311
4-methyl-6-[(3R)-3-(5-methyl-2-pyridinyl)piperidin-1-yl]pyrimidine
CID 95845313
2-imidazol-1-yl-6-[(3R)-1-[(4-methyl-3-pyridinyl)methyl]piperidin-3-yl]pyrazine
CID 124993320
4-[[3-(6-imidazol-1-ylpyrazin-2-yl)piperidin-1-yl]methyl]-2-methyl-1,3-thiazole
CID 110090161
2-imidazol-1-yl-6-[1-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-yl]pyrazine
CID 110091021
2-imidazol-1-yl-6-[(3R)-1-[(5-methyl-1H-pyrazol-4-yl)methyl]piperidin-3-yl]pyrazine
CID 125010570
N-methyl-1-(6-methylpyrimidin-4-yl)piperidin-3-amine
CID 62545669
2-[1-[(5-chloro-2-pyridinyl)methyl]piperidin-3-yl]-6-imidazol-1-ylpyrazine
CID 110090958
1-(6-imidazol-1-ylpyrimidin-4-yl)piperidine-3-carbonitrile
CID 146106492
(3R)-1-(6-imidazol-1-ylpyrimidin-4-yl)piperidine-3-carboxylic acid
CID 95366508
2-[(3R)-3-(3-imidazol-1-ylpyrazin-2-yl)piperidin-1-yl]-4,6-dimethylpyrimidine
CID 95829339

Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine?
The IUPAC name of 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine (CID 110253590) is 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine.
What is the SMILES notation for 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine?
The canonical SMILES for 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine is Cc1cc(N2CCCC(c3cncc(-n4ccnc4)n3)C2)ncn1.
What is the InChIKey of 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine?
The InChIKey is QCIIAYHGUMIVQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N7/c1-13-7-16(21-11-20-13)23-5-2-3-14(10-23)15-8-19-9-17(22-15)24-6-4-18-12-24/h4,6-9,11-12,14H,2-3,5,10H2,1H3.
What are the key properties of 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine?
2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine has a molecular weight of 321.39 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-6-[1-(6-methylpyrimidin-4-yl)piperidin-3-yl]pyrazine is sourced from PubChem (CID 110253590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).