2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine

C14H17N5O — CID 171701885

IUPAC2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine
SMILESCc1cncc(OC2CCN(c3ccncn3)CC2)n1
InChIInChI=1S/C14H17N5O/c1-11-8-16-9-14(18-11)20-12-3-6-19(7-4-12)13-2-5-15-10-17-13/h2,5,8-10,12H,3-4,6-7H2,1H3
InChIKeyGRDBNAOPCNABFG-UHFFFAOYSA-N
MW271.32 g/mol
LogP1.62
Rot. Bonds3

About 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine

2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine (PubChem CID 171701885) has the molecular formula C14H17N5O and a molecular weight of 271.32 g/mol. Its IUPAC name is 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine.

Molecular Properties

Compound Name2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine
PubChem CID171701885
Molecular FormulaC14H17N5O
Molecular Weight271.32 g/mol
Exact Mass271.14
IUPAC Name2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine
SMILESCc1cncc(OC2CCN(c3ccncn3)CC2)n1
InChIInChI=1S/C14H17N5O/c1-11-8-16-9-14(18-11)20-12-3-6-19(7-4-12)13-2-5-15-10-17-13/h2,5,8-10,12H,3-4,6-7H2,1H3
InChIKeyGRDBNAOPCNABFG-UHFFFAOYSA-N
XLogP1.62
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine?
The IUPAC name of 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine (CID 171701885) is 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine.
What is the SMILES notation for 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine?
The canonical SMILES for 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine is Cc1cncc(OC2CCN(c3ccncn3)CC2)n1.
What is the InChIKey of 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine?
The InChIKey is GRDBNAOPCNABFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5O/c1-11-8-16-9-14(18-11)20-12-3-6-19(7-4-12)13-2-5-15-10-17-13/h2,5,8-10,12H,3-4,6-7H2,1H3.
What are the key properties of 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine?
2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine has a molecular weight of 271.32 g/mol, XLogP of 1.62, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(1-pyrimidin-4-ylpiperidin-4-yl)oxypyrazine is sourced from PubChem (CID 171701885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).