6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine

C12H20N4 — CID 117105485

IUPAC6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine
SMILESCCN1CCC(Cc2cc(N)cnn2)CC1
InChIInChI=1S/C12H20N4/c1-2-16-5-3-10(4-6-16)7-12-8-11(13)9-14-15-12/h8-10H,2-7H2,1H3,(H2,13,15)
InChIKeyKYOOGRNEMWGPJE-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.33
Rot. Bonds3

About 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine

6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine (PubChem CID 117105485) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine.

Molecular Properties

Compound Name6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine
PubChem CID117105485
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine
SMILESCCN1CCC(Cc2cc(N)cnn2)CC1
InChIInChI=1S/C12H20N4/c1-2-16-5-3-10(4-6-16)7-12-8-11(13)9-14-15-12/h8-10H,2-7H2,1H3,(H2,13,15)
InChIKeyKYOOGRNEMWGPJE-UHFFFAOYSA-N
XLogP1.33
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine?
The IUPAC name of 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine (CID 117105485) is 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine.
What is the SMILES notation for 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine?
The canonical SMILES for 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine is CCN1CCC(Cc2cc(N)cnn2)CC1.
What is the InChIKey of 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine?
The InChIKey is KYOOGRNEMWGPJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-2-16-5-3-10(4-6-16)7-12-8-11(13)9-14-15-12/h8-10H,2-7H2,1H3,(H2,13,15).
What are the key properties of 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine?
6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine has a molecular weight of 220.32 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1-ethylpiperidin-4-yl)methyl]pyridazin-4-amine is sourced from PubChem (CID 117105485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).