2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine

C15H26N4O — CID 149478332

IUPAC2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine
SMILESCc1cnc(N2CCN(CCOC(C)(C)C)CC2)cn1
InChIInChI=1S/C15H26N4O/c1-13-11-17-14(12-16-13)19-7-5-18(6-8-19)9-10-20-15(2,3)4/h11-12H,5-10H2,1-4H3
InChIKeyZCTDQJUYUNMWOV-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.72
Rot. Bonds4

About 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine

2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine (PubChem CID 149478332) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine.

Molecular Properties

Compound Name2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine
PubChem CID149478332
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine
SMILESCc1cnc(N2CCN(CCOC(C)(C)C)CC2)cn1
InChIInChI=1S/C15H26N4O/c1-13-11-17-14(12-16-13)19-7-5-18(6-8-19)9-10-20-15(2,3)4/h11-12H,5-10H2,1-4H3
InChIKeyZCTDQJUYUNMWOV-UHFFFAOYSA-N
XLogP1.72
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine?
The IUPAC name of 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine (CID 149478332) is 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine.
What is the SMILES notation for 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine?
The canonical SMILES for 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine is Cc1cnc(N2CCN(CCOC(C)(C)C)CC2)cn1.
What is the InChIKey of 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine?
The InChIKey is ZCTDQJUYUNMWOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N4O/c1-13-11-17-14(12-16-13)19-7-5-18(6-8-19)9-10-20-15(2,3)4/h11-12H,5-10H2,1-4H3.
What are the key properties of 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine?
2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine has a molecular weight of 278.40 g/mol, XLogP of 1.72, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-[4-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperazin-1-yl]pyrazine is sourced from PubChem (CID 149478332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).