N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide

C17H22N4O2 — CID 2453107

IUPACN-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)NC[C@H](c2ccco2)N2CCCCC2)cn1
InChIInChI=1S/C17H22N4O2/c1-13-10-19-14(11-18-13)17(22)20-12-15(16-6-5-9-23-16)21-7-3-2-4-8-21/h5-6,9-11,15H,2-4,7-8,12H2,1H3,(H,20,22)/t15-/m1/s1
InChIKeyGISRPQUBZILPNG-OAHLLOKOSA-N
MW314.39 g/mol
LogP2.34
Rot. Bonds5

About N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide

N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide (PubChem CID 2453107) has the molecular formula C17H22N4O2 and a molecular weight of 314.39 g/mol. Its IUPAC name is N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide
PubChem CID2453107
Molecular FormulaC17H22N4O2
Molecular Weight314.39 g/mol
Exact Mass314.17
IUPAC NameN-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide
SMILESCc1cnc(C(=O)NC[C@H](c2ccco2)N2CCCCC2)cn1
InChIInChI=1S/C17H22N4O2/c1-13-10-19-14(11-18-13)17(22)20-12-15(16-6-5-9-23-16)21-7-3-2-4-8-21/h5-6,9-11,15H,2-4,7-8,12H2,1H3,(H,20,22)/t15-/m1/s1
InChIKeyGISRPQUBZILPNG-OAHLLOKOSA-N
XLogP2.34
TPSA71.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.39
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide?
The IUPAC name of N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide (CID 2453107) is N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide?
The canonical SMILES for N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide is Cc1cnc(C(=O)NC[C@H](c2ccco2)N2CCCCC2)cn1.
What is the InChIKey of N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide?
The InChIKey is GISRPQUBZILPNG-OAHLLOKOSA-N. The full InChI is InChI=1S/C17H22N4O2/c1-13-10-19-14(11-18-13)17(22)20-12-15(16-6-5-9-23-16)21-7-3-2-4-8-21/h5-6,9-11,15H,2-4,7-8,12H2,1H3,(H,20,22)/t15-/m1/s1.
What are the key properties of N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide?
N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide has a molecular weight of 314.39 g/mol, XLogP of 2.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-(furan-2-yl)-2-piperidin-1-ylethyl]-5-methylpyrazine-2-carboxamide is sourced from PubChem (CID 2453107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).