2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine

C15H19N5O — CID 165434590

IUPAC2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine
SMILESCc1nccnc1OCC1CCN(c2ncccn2)CC1
InChIInChI=1S/C15H19N5O/c1-12-14(17-8-7-16-12)21-11-13-3-9-20(10-4-13)15-18-5-2-6-19-15/h2,5-8,13H,3-4,9-11H2,1H3
InChIKeySKVMHBRMXFHZLG-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.87
Rot. Bonds4

About 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine

2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine (PubChem CID 165434590) has the molecular formula C15H19N5O and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine.

Molecular Properties

Compound Name2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine
PubChem CID165434590
Molecular FormulaC15H19N5O
Molecular Weight285.35 g/mol
Exact Mass285.16
IUPAC Name2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine
SMILESCc1nccnc1OCC1CCN(c2ncccn2)CC1
InChIInChI=1S/C15H19N5O/c1-12-14(17-8-7-16-12)21-11-13-3-9-20(10-4-13)15-18-5-2-6-19-15/h2,5-8,13H,3-4,9-11H2,1H3
InChIKeySKVMHBRMXFHZLG-UHFFFAOYSA-N
XLogP1.87
TPSA64.03 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine?
The IUPAC name of 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine (CID 165434590) is 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine.
What is the SMILES notation for 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine?
The canonical SMILES for 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine is Cc1nccnc1OCC1CCN(c2ncccn2)CC1.
What is the InChIKey of 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine?
The InChIKey is SKVMHBRMXFHZLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O/c1-12-14(17-8-7-16-12)21-11-13-3-9-20(10-4-13)15-18-5-2-6-19-15/h2,5-8,13H,3-4,9-11H2,1H3.
What are the key properties of 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine?
2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine has a molecular weight of 285.35 g/mol, XLogP of 1.87, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-[(1-pyrimidin-2-ylpiperidin-4-yl)methoxy]pyrazine is sourced from PubChem (CID 165434590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).