5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine

C12H21N5O — CID 122667371

IUPAC5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine
SMILESCOCCN1CCN(Cc2cnc(N)cn2)CC1
InChIInChI=1S/C12H21N5O/c1-18-7-6-16-2-4-17(5-3-16)10-11-8-15-12(13)9-14-11/h8-9H,2-7,10H2,1H3,(H2,13,15)
InChIKeyLVRINDHIXZPSIM-UHFFFAOYSA-N
MW251.33 g/mol
LogP-0.18
Rot. Bonds5

About 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine

5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine (PubChem CID 122667371) has the molecular formula C12H21N5O and a molecular weight of 251.33 g/mol. Its IUPAC name is 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine.

Molecular Properties

Compound Name5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine
PubChem CID122667371
Molecular FormulaC12H21N5O
Molecular Weight251.33 g/mol
Exact Mass251.17
IUPAC Name5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine
SMILESCOCCN1CCN(Cc2cnc(N)cn2)CC1
InChIInChI=1S/C12H21N5O/c1-18-7-6-16-2-4-17(5-3-16)10-11-8-15-12(13)9-14-11/h8-9H,2-7,10H2,1H3,(H2,13,15)
InChIKeyLVRINDHIXZPSIM-UHFFFAOYSA-N
XLogP-0.18
TPSA67.51 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.33
LogP ≤ 5-0.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine?
The IUPAC name of 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine (CID 122667371) is 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine.
What is the SMILES notation for 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine?
The canonical SMILES for 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine is COCCN1CCN(Cc2cnc(N)cn2)CC1.
What is the InChIKey of 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine?
The InChIKey is LVRINDHIXZPSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O/c1-18-7-6-16-2-4-17(5-3-16)10-11-8-15-12(13)9-14-11/h8-9H,2-7,10H2,1H3,(H2,13,15).
What are the key properties of 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine?
5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine has a molecular weight of 251.33 g/mol, XLogP of -0.18, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[[4-(2-methoxyethyl)piperazin-1-yl]methyl]pyrazin-2-amine is sourced from PubChem (CID 122667371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).