N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide

C15H22N4O2 — CID 166605920

IUPACN-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide
SMILESCN(C(=O)C1CC1)C1CCCN(c2nccn(C)c2=O)C1
InChIInChI=1S/C15H22N4O2/c1-17-9-7-16-13(15(17)21)19-8-3-4-12(10-19)18(2)14(20)11-5-6-11/h7,9,11-12H,3-6,8,10H2,1-2H3
InChIKeyXWLDJBUCVVPRIL-UHFFFAOYSA-N
MW290.37 g/mol
LogP0.62
Rot. Bonds3

About N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide

N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide (PubChem CID 166605920) has the molecular formula C15H22N4O2 and a molecular weight of 290.37 g/mol. Its IUPAC name is N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide
PubChem CID166605920
Molecular FormulaC15H22N4O2
Molecular Weight290.37 g/mol
Exact Mass290.17
IUPAC NameN-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide
SMILESCN(C(=O)C1CC1)C1CCCN(c2nccn(C)c2=O)C1
InChIInChI=1S/C15H22N4O2/c1-17-9-7-16-13(15(17)21)19-8-3-4-12(10-19)18(2)14(20)11-5-6-11/h7,9,11-12H,3-6,8,10H2,1-2H3
InChIKeyXWLDJBUCVVPRIL-UHFFFAOYSA-N
XLogP0.62
TPSA58.44 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 50.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide (CID 166605920) is N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide is CN(C(=O)C1CC1)C1CCCN(c2nccn(C)c2=O)C1.
What is the InChIKey of N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide?
The InChIKey is XWLDJBUCVVPRIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O2/c1-17-9-7-16-13(15(17)21)19-8-3-4-12(10-19)18(2)14(20)11-5-6-11/h7,9,11-12H,3-6,8,10H2,1-2H3.
What are the key properties of N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide?
N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide has a molecular weight of 290.37 g/mol, XLogP of 0.62, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[1-(4-methyl-3-oxopyrazin-2-yl)piperidin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 166605920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).