1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide

C11H15N5O2 — CID 110492224

IUPAC1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)Nc2cnccn2)CC1
InChIInChI=1S/C11H15N5O2/c12-10(17)8-1-5-16(6-2-8)11(18)15-9-7-13-3-4-14-9/h3-4,7-8H,1-2,5-6H2,(H2,12,17)(H,14,15,18)
InChIKeyMRJZOSFZJNUJNY-UHFFFAOYSA-N
MW249.27 g/mol
LogP0.21
Rot. Bonds2

About 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide

1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide (PubChem CID 110492224) has the molecular formula C11H15N5O2 and a molecular weight of 249.27 g/mol. Its IUPAC name is 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide
PubChem CID110492224
Molecular FormulaC11H15N5O2
Molecular Weight249.27 g/mol
Exact Mass249.12
IUPAC Name1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide
SMILESNC(=O)C1CCN(C(=O)Nc2cnccn2)CC1
InChIInChI=1S/C11H15N5O2/c12-10(17)8-1-5-16(6-2-8)11(18)15-9-7-13-3-4-14-9/h3-4,7-8H,1-2,5-6H2,(H2,12,17)(H,14,15,18)
InChIKeyMRJZOSFZJNUJNY-UHFFFAOYSA-N
XLogP0.21
TPSA101.21 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.27
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide?
The IUPAC name of 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide (CID 110492224) is 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide is NC(=O)C1CCN(C(=O)Nc2cnccn2)CC1.
What is the InChIKey of 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide?
The InChIKey is MRJZOSFZJNUJNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N5O2/c12-10(17)8-1-5-16(6-2-8)11(18)15-9-7-13-3-4-14-9/h3-4,7-8H,1-2,5-6H2,(H2,12,17)(H,14,15,18).
What are the key properties of 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide?
1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide has a molecular weight of 249.27 g/mol, XLogP of 0.21, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N-pyrazin-2-ylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 110492224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).