5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide

C15H23N5O2 — CID 175859083

IUPAC5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide
SMILESNC(=O)c1cnc(NC2CCOCC2)c(N2CCCCC2)n1
InChIInChI=1S/C15H23N5O2/c16-13(21)12-10-17-14(18-11-4-8-22-9-5-11)15(19-12)20-6-2-1-3-7-20/h10-11H,1-9H2,(H2,16,21)(H,17,18)
InChIKeyGBQYBKHVSMQPCP-UHFFFAOYSA-N
MW305.38 g/mol
LogP1.16
Rot. Bonds4

About 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide

5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide (PubChem CID 175859083) has the molecular formula C15H23N5O2 and a molecular weight of 305.38 g/mol. Its IUPAC name is 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide
PubChem CID175859083
Molecular FormulaC15H23N5O2
Molecular Weight305.38 g/mol
Exact Mass305.19
IUPAC Name5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide
SMILESNC(=O)c1cnc(NC2CCOCC2)c(N2CCCCC2)n1
InChIInChI=1S/C15H23N5O2/c16-13(21)12-10-17-14(18-11-4-8-22-9-5-11)15(19-12)20-6-2-1-3-7-20/h10-11H,1-9H2,(H2,16,21)(H,17,18)
InChIKeyGBQYBKHVSMQPCP-UHFFFAOYSA-N
XLogP1.16
TPSA93.37 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 51.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide?
The IUPAC name of 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide (CID 175859083) is 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide.
What is the SMILES notation for 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide?
The canonical SMILES for 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide is NC(=O)c1cnc(NC2CCOCC2)c(N2CCCCC2)n1.
What is the InChIKey of 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide?
The InChIKey is GBQYBKHVSMQPCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O2/c16-13(21)12-10-17-14(18-11-4-8-22-9-5-11)15(19-12)20-6-2-1-3-7-20/h10-11H,1-9H2,(H2,16,21)(H,17,18).
What are the key properties of 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide?
5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide has a molecular weight of 305.38 g/mol, XLogP of 1.16, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(oxan-4-ylamino)-6-piperidin-1-ylpyrazine-2-carboxamide is sourced from PubChem (CID 175859083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).