N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide

C18H28N4O — CID 109274707

IUPACN-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
SMILESCCC1CCCCN1c1cnc(C(=O)NC2CCCCC2)cn1
InChIInChI=1S/C18H28N4O/c1-2-15-10-6-7-11-22(15)17-13-19-16(12-20-17)18(23)21-14-8-4-3-5-9-14/h12-15H,2-11H2,1H3,(H,21,23)
InChIKeyWUVQGKFLWRMGQW-UHFFFAOYSA-N
MW316.45 g/mol
LogP3.31
Rot. Bonds4

About N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide

N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide (PubChem CID 109274707) has the molecular formula C18H28N4O and a molecular weight of 316.45 g/mol. Its IUPAC name is N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
PubChem CID109274707
Molecular FormulaC18H28N4O
Molecular Weight316.45 g/mol
Exact Mass316.23
IUPAC NameN-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide
SMILESCCC1CCCCN1c1cnc(C(=O)NC2CCCCC2)cn1
InChIInChI=1S/C18H28N4O/c1-2-15-10-6-7-11-22(15)17-13-19-16(12-20-17)18(23)21-14-8-4-3-5-9-14/h12-15H,2-11H2,1H3,(H,21,23)
InChIKeyWUVQGKFLWRMGQW-UHFFFAOYSA-N
XLogP3.31
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide?
The IUPAC name of N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide (CID 109274707) is N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide?
The canonical SMILES for N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide is CCC1CCCCN1c1cnc(C(=O)NC2CCCCC2)cn1.
What is the InChIKey of N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide?
The InChIKey is WUVQGKFLWRMGQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N4O/c1-2-15-10-6-7-11-22(15)17-13-19-16(12-20-17)18(23)21-14-8-4-3-5-9-14/h12-15H,2-11H2,1H3,(H,21,23).
What are the key properties of N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide?
N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide has a molecular weight of 316.45 g/mol, XLogP of 3.31, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-5-(2-ethylpiperidin-1-yl)pyrazine-2-carboxamide is sourced from PubChem (CID 109274707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).