4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine

C10H15BrN4 — CID 117105094

IUPAC4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine
SMILESCCN1CCC(c2cc(Br)c(N)nn2)C1
InChIInChI=1S/C10H15BrN4/c1-2-15-4-3-7(6-15)9-5-8(11)10(12)14-13-9/h5,7H,2-4,6H2,1H3,(H2,12,14)
InChIKeyMJZVPTIHRJOLCX-UHFFFAOYSA-N
MW271.16 g/mol
LogP1.63
Rot. Bonds2

About 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine

4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine (PubChem CID 117105094) has the molecular formula C10H15BrN4 and a molecular weight of 271.16 g/mol. Its IUPAC name is 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine.

Molecular Properties

Compound Name4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine
PubChem CID117105094
Molecular FormulaC10H15BrN4
Molecular Weight271.16 g/mol
Exact Mass270.05
IUPAC Name4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine
SMILESCCN1CCC(c2cc(Br)c(N)nn2)C1
InChIInChI=1S/C10H15BrN4/c1-2-15-4-3-7(6-15)9-5-8(11)10(12)14-13-9/h5,7H,2-4,6H2,1H3,(H2,12,14)
InChIKeyMJZVPTIHRJOLCX-UHFFFAOYSA-N
XLogP1.63
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.16
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine
CID 117105070
4-bromo-6-(1-ethylpiperidin-3-yl)-3-methoxypyridazine
CID 117105672
5-bromo-3-(1-ethylpiperidin-3-yl)-1H-pyridazin-6-one
CID 117105642
3-(1-ethylpyrrolidin-3-yl)-6-methoxypyridazine
CID 117105120
[3-(1-ethylpyrrolidin-3-yl)-1H-pyrazol-5-yl]methanamine
CID 115092182
8-bromo-2-(1-ethylpiperidin-3-yl)imidazo[1,2-a]pyridine
CID 117136361
8-bromo-3-(1-ethylpyrrolidin-3-yl)-[1,2,4]triazolo[4,3-a]pyridine
CID 117146253
6-[(3R)-1-ethylpiperidin-3-yl]-5-methyl-1,2,4-triazin-3-amine
CID 175963971
6-(1-methylpiperidin-3-yl)pyridazine-3,4-diamine
CID 117105593
3-(1-ethylpyrrolidin-3-yl)aniline
CID 46941945
4-bromo-6-(oxan-2-yl)pyridazin-3-amine
CID 117105823
4-chloro-6-(1-propan-2-ylpyrrolidin-3-yl)pyridazin-3-amine
CID 117105087

Frequently Asked Questions

What is the IUPAC name of 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine?
The IUPAC name of 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine (CID 117105094) is 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine.
What is the SMILES notation for 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine?
The canonical SMILES for 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine is CCN1CCC(c2cc(Br)c(N)nn2)C1.
What is the InChIKey of 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine?
The InChIKey is MJZVPTIHRJOLCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15BrN4/c1-2-15-4-3-7(6-15)9-5-8(11)10(12)14-13-9/h5,7H,2-4,6H2,1H3,(H2,12,14).
What are the key properties of 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine?
4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine has a molecular weight of 271.16 g/mol, XLogP of 1.63, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromo-6-(1-ethylpyrrolidin-3-yl)pyridazin-3-amine is sourced from PubChem (CID 117105094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).