[6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine

C14H22N4 — CID 114279559

IUPAC[6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine
SMILESNCc1ccc(N2CCC3(CCCCC3)C2)nn1
InChIInChI=1S/C14H22N4/c15-10-12-4-5-13(17-16-12)18-9-8-14(11-18)6-2-1-3-7-14/h4-5H,1-3,6-11,15H2
InChIKeyVMVZXDKFRIWLLQ-UHFFFAOYSA-N
MW246.36 g/mol
LogP2.10
Rot. Bonds2

About [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine

[6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine (PubChem CID 114279559) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine
PubChem CID114279559
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name[6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine
SMILESNCc1ccc(N2CCC3(CCCCC3)C2)nn1
InChIInChI=1S/C14H22N4/c15-10-12-4-5-13(17-16-12)18-9-8-14(11-18)6-2-1-3-7-14/h4-5H,1-3,6-11,15H2
InChIKeyVMVZXDKFRIWLLQ-UHFFFAOYSA-N
XLogP2.10
TPSA55.04 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 ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine?
The IUPAC name of [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine (CID 114279559) is [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine?
The canonical SMILES for [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine is NCc1ccc(N2CCC3(CCCCC3)C2)nn1.
What is the InChIKey of [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine?
The InChIKey is VMVZXDKFRIWLLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c15-10-12-4-5-13(17-16-12)18-9-8-14(11-18)6-2-1-3-7-14/h4-5H,1-3,6-11,15H2.
What are the key properties of [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine?
[6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine has a molecular weight of 246.36 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-azaspiro[4.5]decan-2-yl)pyridazin-3-yl]methanamine is sourced from PubChem (CID 114279559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).