[3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine

C14H24N4 — CID 55061848

IUPAC[3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine
SMILESCc1nnc(N2CCC(C)CC2C)c(CN)c1C
InChIInChI=1S/C14H24N4/c1-9-5-6-18(10(2)7-9)14-13(8-15)11(3)12(4)16-17-14/h9-10H,5-8,15H2,1-4H3
InChIKeyOOKVDTCZBMUQCD-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.18
Rot. Bonds2

About [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine

[3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine (PubChem CID 55061848) has the molecular formula C14H24N4 and a molecular weight of 248.37 g/mol. Its IUPAC name is [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine
PubChem CID55061848
Molecular FormulaC14H24N4
Molecular Weight248.37 g/mol
Exact Mass248.20
IUPAC Name[3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine
SMILESCc1nnc(N2CCC(C)CC2C)c(CN)c1C
InChIInChI=1S/C14H24N4/c1-9-5-6-18(10(2)7-9)14-13(8-15)11(3)12(4)16-17-14/h9-10H,5-8,15H2,1-4H3
InChIKeyOOKVDTCZBMUQCD-UHFFFAOYSA-N
XLogP2.18
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
The IUPAC name of [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine (CID 55061848) is [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine.
What is the SMILES notation for [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
The canonical SMILES for [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine is Cc1nnc(N2CCC(C)CC2C)c(CN)c1C.
What is the InChIKey of [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
The InChIKey is OOKVDTCZBMUQCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N4/c1-9-5-6-18(10(2)7-9)14-13(8-15)11(3)12(4)16-17-14/h9-10H,5-8,15H2,1-4H3.
What are the key properties of [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine?
[3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine has a molecular weight of 248.37 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2,4-dimethylpiperidin-1-yl)-5,6-dimethylpyridazin-4-yl]methanamine is sourced from PubChem (CID 55061848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).