N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine

C13H20N4 — CID 126916780

IUPACN-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine
SMILESCc1ccc(N2CC(CNC3CCC3)C2)nn1
InChIInChI=1S/C13H20N4/c1-10-5-6-13(16-15-10)17-8-11(9-17)7-14-12-3-2-4-12/h5-6,11-12,14H,2-4,7-9H2,1H3
InChIKeySELJAISGUREYKM-UHFFFAOYSA-N
MW232.33 g/mol
LogP1.36
Rot. Bonds4

About N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine

N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine (PubChem CID 126916780) has the molecular formula C13H20N4 and a molecular weight of 232.33 g/mol. Its IUPAC name is N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine.

Molecular Properties

Compound NameN-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine
PubChem CID126916780
Molecular FormulaC13H20N4
Molecular Weight232.33 g/mol
Exact Mass232.17
IUPAC NameN-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine
SMILESCc1ccc(N2CC(CNC3CCC3)C2)nn1
InChIInChI=1S/C13H20N4/c1-10-5-6-13(16-15-10)17-8-11(9-17)7-14-12-3-2-4-12/h5-6,11-12,14H,2-4,7-9H2,1H3
InChIKeySELJAISGUREYKM-UHFFFAOYSA-N
XLogP1.36
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrrolidine-1-sulfonamide
CID 126916696
[(3R)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]methanamine
CID 94342238
[1-(6-methylpyridazin-3-yl)piperidin-3-yl]methanol
CID 61313722
3-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]-1,2,4-oxadiazol-5-amine
CID 126916846
(3S)-N-[(5-methylfuran-2-yl)methyl]-1-(6-methylpyridazin-3-yl)piperidin-3-amine
CID 95340373
2-methyl-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]pyrazolo[1,5-a]pyrazin-4-amine
CID 126916736
N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]thieno[2,3-d]pyrimidin-4-amine
CID 126916741
N,N-dimethyl-5-[[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methylamino]methyl]-1,3-thiazol-2-amine
CID 126916800
5-(methoxymethyl)-N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]-1,3,4-thiadiazol-2-amine
CID 126916841
N-[[1-(6-tert-butylpyridazin-3-yl)azetidin-3-yl]methyl]-8-methyl-8-azabicyclo[3.2.1]octan-3-amine
CID 126917981
1-(6-methylpyridazin-3-yl)piperidin-4-amine
CID 61311173
6-methyl-N-[[1-(6-pyridin-4-ylpyridazin-3-yl)azetidin-3-yl]methyl]pyridazin-3-amine
CID 126920030

Frequently Asked Questions

What is the IUPAC name of N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine?
The IUPAC name of N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine (CID 126916780) is N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine.
What is the SMILES notation for N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine?
The canonical SMILES for N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine is Cc1ccc(N2CC(CNC3CCC3)C2)nn1.
What is the InChIKey of N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine?
The InChIKey is SELJAISGUREYKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N4/c1-10-5-6-13(16-15-10)17-8-11(9-17)7-14-12-3-2-4-12/h5-6,11-12,14H,2-4,7-9H2,1H3.
What are the key properties of N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine?
N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine has a molecular weight of 232.33 g/mol, XLogP of 1.36, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(6-methylpyridazin-3-yl)azetidin-3-yl]methyl]cyclobutanamine is sourced from PubChem (CID 126916780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).