4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine

C19H20N6 — CID 19894608

IUPAC4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine
SMILESCC1CNCCN1c1cc(-c2ccccn2)nnc1-c1ccccn1
InChIInChI=1S/C19H20N6/c1-14-13-20-10-11-25(14)18-12-17(15-6-2-4-8-21-15)23-24-19(18)16-7-3-5-9-22-16/h2-9,12,14,20H,10-11,13H2,1H3
InChIKeyCUWXOGKSGRRGDU-UHFFFAOYSA-N
MW332.41 g/mol
LogP2.40
Rot. Bonds3

About 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine

4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine (PubChem CID 19894608) has the molecular formula C19H20N6 and a molecular weight of 332.41 g/mol. Its IUPAC name is 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine.

Molecular Properties

Compound Name4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine
PubChem CID19894608
Molecular FormulaC19H20N6
Molecular Weight332.41 g/mol
Exact Mass332.17
IUPAC Name4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine
SMILESCC1CNCCN1c1cc(-c2ccccn2)nnc1-c1ccccn1
InChIInChI=1S/C19H20N6/c1-14-13-20-10-11-25(14)18-12-17(15-6-2-4-8-21-15)23-24-19(18)16-7-3-5-9-22-16/h2-9,12,14,20H,10-11,13H2,1H3
InChIKeyCUWXOGKSGRRGDU-UHFFFAOYSA-N
XLogP2.40
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.41
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(2R)-2-methyl-1-pyridin-2-ylpiperazine;hydrochloride
CID 134500587
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5-chloro-6-methyl-2-(2-methylpiperazin-1-yl)-7-pyridin-2-yl-1,3-benzoxazole
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(2R)-2-methyl-1-(pyridin-2-ylmethyl)piperazine
CID 67972243
5-[[(2R)-2-methylpiperazin-1-yl]methyl]-3-pyridin-2-yl-1,2,4-oxadiazole
CID 82713825
(2R)-1-(2-fluoro-5-phenylphenyl)-2-methylpiperazine
CID 11543595
2-(2-methylpiperazin-1-yl)benzamide
CID 22411270
4-[4-[(2S)-2-methylpiperazin-1-yl]phthalazin-1-yl]benzonitrile
CID 58378973
4-methyl-5-(2-methylpiperazin-1-yl)pyrimidine
CID 82669790
1-(3-methoxy-2-pyridinyl)-2-methylpiperazine;hydrochloride
CID 162079828
2-[(2R)-2-methylpiperazin-1-yl]pyridine-3-carbonitrile
CID 94546211
5-chloro-2-(2-methylpiperazin-1-yl)-7-pyridin-2-yl-6-(trifluoromethyl)-1,3-benzoxazole
CID 121331223

Frequently Asked Questions

What is the IUPAC name of 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine?
The IUPAC name of 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine (CID 19894608) is 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine.
What is the SMILES notation for 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine?
The canonical SMILES for 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine is CC1CNCCN1c1cc(-c2ccccn2)nnc1-c1ccccn1.
What is the InChIKey of 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine?
The InChIKey is CUWXOGKSGRRGDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N6/c1-14-13-20-10-11-25(14)18-12-17(15-6-2-4-8-21-15)23-24-19(18)16-7-3-5-9-22-16/h2-9,12,14,20H,10-11,13H2,1H3.
What are the key properties of 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine?
4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine has a molecular weight of 332.41 g/mol, XLogP of 2.40, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylpiperazin-1-yl)-3,6-dipyridin-2-ylpyridazine is sourced from PubChem (CID 19894608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).