(4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone

C14H23N5O — CID 109270974

IUPAC(4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
SMILESCCCNc1cnc(C(=O)N2CCN(CC)CC2)cn1
InChIInChI=1S/C14H23N5O/c1-3-5-15-13-11-16-12(10-17-13)14(20)19-8-6-18(4-2)7-9-19/h10-11H,3-9H2,1-2H3,(H,15,17)
InChIKeyGBODEYJTLGKATE-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.08
Rot. Bonds5

About (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone

(4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone (PubChem CID 109270974) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone.

Molecular Properties

Compound Name(4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
PubChem CID109270974
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC Name(4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
SMILESCCCNc1cnc(C(=O)N2CCN(CC)CC2)cn1
InChIInChI=1S/C14H23N5O/c1-3-5-15-13-11-16-12(10-17-13)14(20)19-8-6-18(4-2)7-9-19/h10-11H,3-9H2,1-2H3,(H,15,17)
InChIKeyGBODEYJTLGKATE-UHFFFAOYSA-N
XLogP1.08
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(4-ethylpiperazin-1-yl)-[5-(2-morpholin-4-ylethylamino)pyrazin-2-yl]methanone
CID 109277598
(3,4-dihydroxypyrrolidin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
CID 107377330
(4-ethylpiperazin-1-yl)-[6-(propylamino)-3-pyridinyl]methanone
CID 62172305
[5-(cyclopentylamino)pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone
CID 109274083
(4-ethylpiperazin-1-yl)-[5-[2-(2-methoxyphenyl)ethylamino]pyrazin-2-yl]methanone
CID 109278444
[5-(butylamino)pyrazin-2-yl]-pyrrolidin-1-ylmethanone
CID 109272535
[5-[2-(3,4-dimethoxyphenyl)ethylamino]pyrazin-2-yl]-(4-ethylpiperazin-1-yl)methanone
CID 109278454
(5-anilinopyrazin-2-yl)-(4-ethylpiperazin-1-yl)methanone
CID 109278481
(2,2-dimethylthiomorpholin-4-yl)-[5-(propylamino)pyrazin-2-yl]methanone
CID 107376996
1,3-dihydroisoindol-2-yl-[5-(propylamino)pyrazin-2-yl]methanone
CID 107375381
(4-ethylpiperazin-1-yl)-[5-(4-fluoroanilino)pyrazin-2-yl]methanone
CID 109278506
(4-hydroxy-3-methylpiperidin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone
CID 107377097

Frequently Asked Questions

What is the IUPAC name of (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone?
The IUPAC name of (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone (CID 109270974) is (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone.
What is the SMILES notation for (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone?
The canonical SMILES for (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone is CCCNc1cnc(C(=O)N2CCN(CC)CC2)cn1.
What is the InChIKey of (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone?
The InChIKey is GBODEYJTLGKATE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-3-5-15-13-11-16-12(10-17-13)14(20)19-8-6-18(4-2)7-9-19/h10-11H,3-9H2,1-2H3,(H,15,17).
What are the key properties of (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone?
(4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone has a molecular weight of 277.37 g/mol, XLogP of 1.08, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-ethylpiperazin-1-yl)-[5-(propylamino)pyrazin-2-yl]methanone is sourced from PubChem (CID 109270974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).