3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine

C14H22N4 — CID 63257237

IUPAC3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine
SMILESCc1ccc(N2CCC(C3CCCN3)CC2)nn1
InChIInChI=1S/C14H22N4/c1-11-4-5-14(17-16-11)18-9-6-12(7-10-18)13-3-2-8-15-13/h4-5,12-13,15H,2-3,6-10H2,1H3
InChIKeySFTFAPBOUDLKFA-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.75
Rot. Bonds2

About 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine

3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine (PubChem CID 63257237) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine.

Molecular Properties

Compound Name3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine
PubChem CID63257237
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine
SMILESCc1ccc(N2CCC(C3CCCN3)CC2)nn1
InChIInChI=1S/C14H22N4/c1-11-4-5-14(17-16-11)18-9-6-12(7-10-18)13-3-2-8-15-13/h4-5,12-13,15H,2-3,6-10H2,1H3
InChIKeySFTFAPBOUDLKFA-UHFFFAOYSA-N
XLogP1.75
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine
CID 63257105
4-methyl-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine
CID 63257496
4-methyl-2-propan-2-yl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine
CID 63257362
3-methyl-6-(4-methylpiperidin-1-yl)pyridazine
CID 59712116
1-(6-methylpyridazin-3-yl)piperidin-4-amine
CID 61311173
3-methyl-6-(3-methylpiperazin-1-yl)pyridazine
CID 62478379
2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyrimidine
CID 55167443
5-methoxy-2-methyl-4-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine
CID 106660829
3-(3-pyrrolidin-2-ylpiperidin-1-yl)pyridazine
CID 62484087
3-chloro-2-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridine
CID 63257582
1-(4-methyl-1-prop-2-enylimidazol-2-yl)-4-pyrrolidin-2-ylpiperidine
CID 106552601
3-methyl-6-(4-prop-1-en-2-ylpiperidin-1-yl)pyridazine
CID 89276627

Frequently Asked Questions

What is the IUPAC name of 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine?
The IUPAC name of 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine (CID 63257237) is 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine.
What is the SMILES notation for 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine?
The canonical SMILES for 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine is Cc1ccc(N2CCC(C3CCCN3)CC2)nn1.
What is the InChIKey of 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine?
The InChIKey is SFTFAPBOUDLKFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-11-4-5-14(17-16-11)18-9-6-12(7-10-18)13-3-2-8-15-13/h4-5,12-13,15H,2-3,6-10H2,1H3.
What are the key properties of 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine?
3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine has a molecular weight of 246.36 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-6-(4-pyrrolidin-2-ylpiperidin-1-yl)pyridazine is sourced from PubChem (CID 63257237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).