2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine

C18H24N4O — CID 170863223

IUPAC2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine
SMILESCN1CCN(CCCc2ccccc2Oc2cnccn2)CC1
InChIInChI=1S/C18H24N4O/c1-21-11-13-22(14-12-21)10-4-6-16-5-2-3-7-17(16)23-18-15-19-8-9-20-18/h2-3,5,7-9,15H,4,6,10-14H2,1H3
InChIKeyUZKZAOKJQDAJKW-UHFFFAOYSA-N
MW312.42 g/mol
LogP2.45
Rot. Bonds6

About 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine

2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine (PubChem CID 170863223) has the molecular formula C18H24N4O and a molecular weight of 312.42 g/mol. Its IUPAC name is 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine.

Molecular Properties

Compound Name2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine
PubChem CID170863223
Molecular FormulaC18H24N4O
Molecular Weight312.42 g/mol
Exact Mass312.20
IUPAC Name2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine
SMILESCN1CCN(CCCc2ccccc2Oc2cnccn2)CC1
InChIInChI=1S/C18H24N4O/c1-21-11-13-22(14-12-21)10-4-6-16-5-2-3-7-17(16)23-18-15-19-8-9-20-18/h2-3,5,7-9,15H,4,6,10-14H2,1H3
InChIKeyUZKZAOKJQDAJKW-UHFFFAOYSA-N
XLogP2.45
TPSA41.49 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.42
LogP ≤ 52.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-methyl-4-[3-(2-pentoxyphenyl)propyl]piperazine
CID 170863422
1-methyl-4-[3-[2-(2-pyrrolidin-1-ylethoxy)phenyl]propyl]piperazine
CID 170863761
1-methyl-4-[3-(2-prop-2-enoxyphenyl)propyl]piperazine
CID 170862374
N-methyl-1-(2-pyrazin-2-yloxyphenyl)methanamine
CID 106485481
1-methyl-4-[3-[2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenyl]phenyl]propyl]piperazine
CID 170863059
2-[4-[3-(4-methylpiperazin-1-yl)propyl]phenyl]pyrazine
CID 170863154
1-methyl-4-[3-[2-(oxan-4-yloxy)phenyl]propyl]piperazine
CID 170863354
2-[3-(4-methylpiperazin-1-yl)propyl]benzenesulfonic acid
CID 170862354
1-methyl-4-[3-[2-(trifluoromethyl)phenyl]propyl]piperazine
CID 170862295
2-(2-bromophenoxy)pyrazine
CID 14689440
2-(2-iodophenoxy)pyrazine
CID 60965646
1-methyl-4-[3-[3-(pyridin-3-ylmethoxy)phenyl]propyl]piperazine
CID 170863930

Frequently Asked Questions

What is the IUPAC name of 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine?
The IUPAC name of 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine (CID 170863223) is 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine.
What is the SMILES notation for 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine?
The canonical SMILES for 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine is CN1CCN(CCCc2ccccc2Oc2cnccn2)CC1.
What is the InChIKey of 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine?
The InChIKey is UZKZAOKJQDAJKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N4O/c1-21-11-13-22(14-12-21)10-4-6-16-5-2-3-7-17(16)23-18-15-19-8-9-20-18/h2-3,5,7-9,15H,4,6,10-14H2,1H3.
What are the key properties of 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine?
2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine has a molecular weight of 312.42 g/mol, XLogP of 2.45, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]pyrazine is sourced from PubChem (CID 170863223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).