(3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone

C14H22N4O — CID 107376989

IUPAC(3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone
SMILESCCNc1cnc(C(=O)N2CCC(C)C(C)C2)cn1
InChIInChI=1S/C14H22N4O/c1-4-15-13-8-16-12(7-17-13)14(19)18-6-5-10(2)11(3)9-18/h7-8,10-11H,4-6,9H2,1-3H3,(H,15,17)
InChIKeyKXTKLCXAYJVDQQ-UHFFFAOYSA-N
MW262.36 g/mol
LogP2.03
Rot. Bonds3

About (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone

(3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone (PubChem CID 107376989) has the molecular formula C14H22N4O and a molecular weight of 262.36 g/mol. Its IUPAC name is (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone.

Molecular Properties

Compound Name(3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone
PubChem CID107376989
Molecular FormulaC14H22N4O
Molecular Weight262.36 g/mol
Exact Mass262.18
IUPAC Name(3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone
SMILESCCNc1cnc(C(=O)N2CCC(C)C(C)C2)cn1
InChIInChI=1S/C14H22N4O/c1-4-15-13-8-16-12(7-17-13)14(19)18-6-5-10(2)11(3)9-18/h7-8,10-11H,4-6,9H2,1-3H3,(H,15,17)
InChIKeyKXTKLCXAYJVDQQ-UHFFFAOYSA-N
XLogP2.03
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.36
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone with MolForge

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Related Compounds

[5-(ethylamino)pyrazin-2-yl]-(9-methyl-3,9-diazabicyclo[4.2.1]nonan-3-yl)methanone
CID 107376098
[5-(ethylamino)pyrazin-2-yl]-[3-(hydroxymethyl)piperidin-1-yl]methanone
CID 107373865
(4-hydroxy-3-methylpiperidin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
CID 107377097
[5-(ethylamino)pyrazin-2-yl]-(4-methylazepan-1-yl)methanone
CID 107375687
(3,4-dimethylpiperazin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone
CID 107375674
[5-(ethylamino)pyrazin-2-yl]-(3-ethylpiperidin-1-yl)methanone
CID 107374588
1,3,4,5,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-2-yl-[5-(ethylamino)pyrazin-2-yl]methanone
CID 107375576
[5-(ethylamino)-2-pyridinyl]-(3-hydroxy-4-methylpiperidin-1-yl)methanone
CID 102964695
[3-(1-hydroxyethyl)pyrrolidin-1-yl]-[5-(propylamino)pyrazin-2-yl]methanone
CID 107376688
[6-(ethylamino)-3-pyridinyl]-(3-methylpyrrolidin-1-yl)methanone
CID 62180267
(2,2-dimethylpyrrolidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone
CID 107375601
(3,4-dihydroxypyrrolidin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
CID 107377330

Frequently Asked Questions

What is the IUPAC name of (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone?
The IUPAC name of (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone (CID 107376989) is (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone.
What is the SMILES notation for (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone?
The canonical SMILES for (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone is CCNc1cnc(C(=O)N2CCC(C)C(C)C2)cn1.
What is the InChIKey of (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone?
The InChIKey is KXTKLCXAYJVDQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4O/c1-4-15-13-8-16-12(7-17-13)14(19)18-6-5-10(2)11(3)9-18/h7-8,10-11H,4-6,9H2,1-3H3,(H,15,17).
What are the key properties of (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone?
(3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone has a molecular weight of 262.36 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-dimethylpiperidin-1-yl)-[5-(ethylamino)pyrazin-2-yl]methanone is sourced from PubChem (CID 107376989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).