N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide

C15H22N4O2 — CID 5171167

IUPACN-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(NCC1CCCO1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C15H22N4O2/c20-15(18-10-13-2-1-9-21-13)12-3-7-19(8-4-12)14-11-16-5-6-17-14/h5-6,11-13H,1-4,7-10H2,(H,18,20)
InChIKeyJXZVPEGIYQEEJC-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.99
Rot. Bonds4

About N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide

N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide (PubChem CID 5171167) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide.

Molecular Properties

Compound NameN-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide
PubChem CID5171167
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide
SMILESO=C(NCC1CCCO1)C1CCN(c2cnccn2)CC1
InChIInChI=1S/C15H22N4O2/c20-15(18-10-13-2-1-9-21-13)12-3-7-19(8-4-12)14-11-16-5-6-17-14/h5-6,11-13H,1-4,7-10H2,(H,18,20)
InChIKeyJXZVPEGIYQEEJC-UHFFFAOYSA-N
XLogP0.99
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
The IUPAC name of N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide (CID 5171167) is N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide.
What is the SMILES notation for N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
The canonical SMILES for N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide is O=C(NCC1CCCO1)C1CCN(c2cnccn2)CC1.
What is the InChIKey of N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
The InChIKey is JXZVPEGIYQEEJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c20-15(18-10-13-2-1-9-21-13)12-3-7-19(8-4-12)14-11-16-5-6-17-14/h5-6,11-13H,1-4,7-10H2,(H,18,20).
What are the key properties of N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide?
N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide has a molecular weight of 290.37 g/mol, XLogP of 0.99, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-2-ylmethyl)-1-pyrazin-2-ylpiperidine-4-carboxamide is sourced from PubChem (CID 5171167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).