(5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone

C13H22N6O — CID 107375502

IUPAC(5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
SMILESCN(C)CCN1CCN(C(=O)c2cnc(N)cn2)CC1
InChIInChI=1S/C13H22N6O/c1-17(2)3-4-18-5-7-19(8-6-18)13(20)11-9-16-12(14)10-15-11/h9-10H,3-8H2,1-2H3,(H2,14,16)
InChIKeyRZVRLOZXNIDCHY-UHFFFAOYSA-N
MW278.36 g/mol
LogP-0.62
Rot. Bonds4

About (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone

(5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone (PubChem CID 107375502) has the molecular formula C13H22N6O and a molecular weight of 278.36 g/mol. Its IUPAC name is (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone.

Molecular Properties

Compound Name(5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
PubChem CID107375502
Molecular FormulaC13H22N6O
Molecular Weight278.36 g/mol
Exact Mass278.19
IUPAC Name(5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
SMILESCN(C)CCN1CCN(C(=O)c2cnc(N)cn2)CC1
InChIInChI=1S/C13H22N6O/c1-17(2)3-4-18-5-7-19(8-6-18)13(20)11-9-16-12(14)10-15-11/h9-10H,3-8H2,1-2H3,(H2,14,16)
InChIKeyRZVRLOZXNIDCHY-UHFFFAOYSA-N
XLogP-0.62
TPSA78.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.36
LogP ≤ 5-0.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(5-bromo-2-pyridinyl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 62952392
(6-chloro-3-pyridinyl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 60712392
(5-chloropyrazin-2-yl)-[4-(2-hydroxyethyl)piperazin-1-yl]methanone
CID 103817134
(4-amino-1-methylpyrrol-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 62886059
(2,4-diaminophenyl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 62887479
(2-amino-3-chlorophenyl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 115540648
(2-chloro-3-pyridinyl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 60715997
[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-(4-sulfanylphenyl)methanone
CID 107028812
2-amino-1-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]-2-(1-methylpyrazol-4-yl)ethanone
CID 115290639
(3-amino-4-bromophenyl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 62884852
(2,3-dihydroxyphenyl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone
CID 114344314
(4-benzylpiperazin-1-yl)-[5-[2-(dimethylamino)ethylamino]pyrazin-2-yl]methanone
CID 109277312

Frequently Asked Questions

What is the IUPAC name of (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone?
The IUPAC name of (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone (CID 107375502) is (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone.
What is the SMILES notation for (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone?
The canonical SMILES for (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone is CN(C)CCN1CCN(C(=O)c2cnc(N)cn2)CC1.
What is the InChIKey of (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone?
The InChIKey is RZVRLOZXNIDCHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N6O/c1-17(2)3-4-18-5-7-19(8-6-18)13(20)11-9-16-12(14)10-15-11/h9-10H,3-8H2,1-2H3,(H2,14,16).
What are the key properties of (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone?
(5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone has a molecular weight of 278.36 g/mol, XLogP of -0.62, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5-aminopyrazin-2-yl)-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]methanone is sourced from PubChem (CID 107375502), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).