3-(4-methylpiperazin-1-yl)-6-phenylpyridazine

C15H18N4 — CID 10354969

IUPAC3-(4-methylpiperazin-1-yl)-6-phenylpyridazine
SMILESCN1CCN(c2ccc(-c3ccccc3)nn2)CC1
InChIInChI=1S/C15H18N4/c1-18-9-11-19(12-10-18)15-8-7-14(16-17-15)13-5-3-2-4-6-13/h2-8H,9-12H2,1H3
InChIKeyJGGDRYMPCVSLML-UHFFFAOYSA-N
MW254.34 g/mol
LogP1.90
Rot. Bonds2

About 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine

3-(4-methylpiperazin-1-yl)-6-phenylpyridazine (PubChem CID 10354969) has the molecular formula C15H18N4 and a molecular weight of 254.34 g/mol. Its IUPAC name is 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine.

Molecular Properties

Compound Name3-(4-methylpiperazin-1-yl)-6-phenylpyridazine
PubChem CID10354969
Molecular FormulaC15H18N4
Molecular Weight254.34 g/mol
Exact Mass254.15
IUPAC Name3-(4-methylpiperazin-1-yl)-6-phenylpyridazine
SMILESCN1CCN(c2ccc(-c3ccccc3)nn2)CC1
InChIInChI=1S/C15H18N4/c1-18-9-11-19(12-10-18)15-8-7-14(16-17-15)13-5-3-2-4-6-13/h2-8H,9-12H2,1H3
InChIKeyJGGDRYMPCVSLML-UHFFFAOYSA-N
XLogP1.90
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.34
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine?
The IUPAC name of 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine (CID 10354969) is 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine.
What is the SMILES notation for 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine?
The canonical SMILES for 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine is CN1CCN(c2ccc(-c3ccccc3)nn2)CC1.
What is the InChIKey of 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine?
The InChIKey is JGGDRYMPCVSLML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4/c1-18-9-11-19(12-10-18)15-8-7-14(16-17-15)13-5-3-2-4-6-13/h2-8H,9-12H2,1H3.
What are the key properties of 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine?
3-(4-methylpiperazin-1-yl)-6-phenylpyridazine has a molecular weight of 254.34 g/mol, XLogP of 1.90, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylpiperazin-1-yl)-6-phenylpyridazine is sourced from PubChem (CID 10354969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).