[5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone

C15H22N4O2 — CID 110255712

IUPAC[5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone
SMILESCN1CCCC(c2cnc(C(=O)N3CCOCC3)cn2)C1
InChIInChI=1S/C15H22N4O2/c1-18-4-2-3-12(11-18)13-9-17-14(10-16-13)15(20)19-5-7-21-8-6-19/h9-10,12H,2-8,11H2,1H3
InChIKeyMKZAEKJODRDLSB-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.76
Rot. Bonds2

About [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone

[5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone (PubChem CID 110255712) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone
PubChem CID110255712
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC Name[5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone
SMILESCN1CCCC(c2cnc(C(=O)N3CCOCC3)cn2)C1
InChIInChI=1S/C15H22N4O2/c1-18-4-2-3-12(11-18)13-9-17-14(10-16-13)15(20)19-5-7-21-8-6-19/h9-10,12H,2-8,11H2,1H3
InChIKeyMKZAEKJODRDLSB-UHFFFAOYSA-N
XLogP0.76
TPSA58.56 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone?
The IUPAC name of [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone (CID 110255712) is [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone is CN1CCCC(c2cnc(C(=O)N3CCOCC3)cn2)C1.
What is the InChIKey of [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone?
The InChIKey is MKZAEKJODRDLSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-18-4-2-3-12(11-18)13-9-17-14(10-16-13)15(20)19-5-7-21-8-6-19/h9-10,12H,2-8,11H2,1H3.
What are the key properties of [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone?
[5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone has a molecular weight of 290.37 g/mol, XLogP of 0.76, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(1-methylpiperidin-3-yl)pyrazin-2-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 110255712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).