5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide

C17H27N5O2 — CID 109275191

IUPAC5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESCC1CCN(c2cnc(C(=O)NCCN3CCOCC3)cn2)CC1
InChIInChI=1S/C17H27N5O2/c1-14-2-5-22(6-3-14)16-13-19-15(12-20-16)17(23)18-4-7-21-8-10-24-11-9-21/h12-14H,2-11H2,1H3,(H,18,23)
InChIKeyAMNGJTNDDTWYCJ-UHFFFAOYSA-N
MW333.44 g/mol
LogP0.77
Rot. Bonds5

About 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide

5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide (PubChem CID 109275191) has the molecular formula C17H27N5O2 and a molecular weight of 333.44 g/mol. Its IUPAC name is 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide.

Molecular Properties

Compound Name5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
PubChem CID109275191
Molecular FormulaC17H27N5O2
Molecular Weight333.44 g/mol
Exact Mass333.22
IUPAC Name5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide
SMILESCC1CCN(c2cnc(C(=O)NCCN3CCOCC3)cn2)CC1
InChIInChI=1S/C17H27N5O2/c1-14-2-5-22(6-3-14)16-13-19-15(12-20-16)17(23)18-4-7-21-8-10-24-11-9-21/h12-14H,2-11H2,1H3,(H,18,23)
InChIKeyAMNGJTNDDTWYCJ-UHFFFAOYSA-N
XLogP0.77
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.44
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The IUPAC name of 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide (CID 109275191) is 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide.
What is the SMILES notation for 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The canonical SMILES for 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide is CC1CCN(c2cnc(C(=O)NCCN3CCOCC3)cn2)CC1.
What is the InChIKey of 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
The InChIKey is AMNGJTNDDTWYCJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N5O2/c1-14-2-5-22(6-3-14)16-13-19-15(12-20-16)17(23)18-4-7-21-8-10-24-11-9-21/h12-14H,2-11H2,1H3,(H,18,23).
What are the key properties of 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide?
5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide has a molecular weight of 333.44 g/mol, XLogP of 0.77, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methylpiperidin-1-yl)-N-(2-morpholin-4-ylethyl)pyrazine-2-carboxamide is sourced from PubChem (CID 109275191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).