[5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine

C15H25N5 — CID 63171746

IUPAC[5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine
SMILESCc1nnc(N2CCC(N3CCCC3)C2)c(CN)c1C
InChIInChI=1S/C15H25N5/c1-11-12(2)17-18-15(14(11)9-16)20-8-5-13(10-20)19-6-3-4-7-19/h13H,3-10,16H2,1-2H3
InChIKeyUKBHVJQZXFHPOJ-UHFFFAOYSA-N
MW275.40 g/mol
LogP1.23
Rot. Bonds3

About [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine

[5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine (PubChem CID 63171746) has the molecular formula C15H25N5 and a molecular weight of 275.40 g/mol. Its IUPAC name is [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine.

Molecular Properties

Compound Name[5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine
PubChem CID63171746
Molecular FormulaC15H25N5
Molecular Weight275.40 g/mol
Exact Mass275.21
IUPAC Name[5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine
SMILESCc1nnc(N2CCC(N3CCCC3)C2)c(CN)c1C
InChIInChI=1S/C15H25N5/c1-11-12(2)17-18-15(14(11)9-16)20-8-5-13(10-20)19-6-3-4-7-19/h13H,3-10,16H2,1-2H3
InChIKeyUKBHVJQZXFHPOJ-UHFFFAOYSA-N
XLogP1.23
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.40
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine?
The IUPAC name of [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine (CID 63171746) is [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine.
What is the SMILES notation for [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine?
The canonical SMILES for [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine is Cc1nnc(N2CCC(N3CCCC3)C2)c(CN)c1C.
What is the InChIKey of [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine?
The InChIKey is UKBHVJQZXFHPOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N5/c1-11-12(2)17-18-15(14(11)9-16)20-8-5-13(10-20)19-6-3-4-7-19/h13H,3-10,16H2,1-2H3.
What are the key properties of [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine?
[5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine has a molecular weight of 275.40 g/mol, XLogP of 1.23, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5,6-dimethyl-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridazin-4-yl]methanamine is sourced from PubChem (CID 63171746), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).