1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine

C12H19N3 — CID 106895211

IUPAC1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine
SMILESCC(CC1CCC1)NCc1cccnn1
InChIInChI=1S/C12H19N3/c1-10(8-11-4-2-5-11)13-9-12-6-3-7-14-15-12/h3,6-7,10-11,13H,2,4-5,8-9H2,1H3
InChIKeyDQLIWXGOGDRIHB-UHFFFAOYSA-N
MW205.31 g/mol
LogP2.14
Rot. Bonds5

About 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine

1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine (PubChem CID 106895211) has the molecular formula C12H19N3 and a molecular weight of 205.31 g/mol. Its IUPAC name is 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine.

Molecular Properties

Compound Name1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine
PubChem CID106895211
Molecular FormulaC12H19N3
Molecular Weight205.31 g/mol
Exact Mass205.16
IUPAC Name1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine
SMILESCC(CC1CCC1)NCc1cccnn1
InChIInChI=1S/C12H19N3/c1-10(8-11-4-2-5-11)13-9-12-6-3-7-14-15-12/h3,6-7,10-11,13H,2,4-5,8-9H2,1H3
InChIKeyDQLIWXGOGDRIHB-UHFFFAOYSA-N
XLogP2.14
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.31
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(pyridazin-3-ylmethyl)heptan-2-amine
CID 106895304
N-benzyl-1-cyclopentylpropan-2-amine
CID 71379591
1-(furan-2-yl)-N-(pyridazin-3-ylmethyl)propan-2-amine
CID 106894984
1-cyclobutyl-N-(2-pyridin-3-ylethyl)propan-2-amine
CID 115709042
1-cyclopropyl-1-(4-fluorophenyl)-N-(pyridazin-3-ylmethyl)methanamine
CID 106895187
1-(2-methoxyphenyl)-N-(pyridazin-3-ylmethyl)propan-2-amine
CID 106895370
2-(pyridazin-3-ylmethylamino)-1-pyrrolidin-1-ylpropan-1-one
CID 106832007
4-[1-(pyridazin-3-ylmethylamino)ethyl]phenol
CID 106895349
1,1-diphenyl-N-(pyridazin-3-ylmethyl)methanamine
CID 106895014
N-(1-cyclobutylpropan-2-yl)-2-propan-2-yloxypyridin-3-amine
CID 113489848
1-piperidin-3-yl-N-(pyridazin-3-ylmethyl)methanamine
CID 106895080
1-cyclobutyl-N-(2-phenylethyl)propan-2-amine
CID 115705957

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine?
The IUPAC name of 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine (CID 106895211) is 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine.
What is the SMILES notation for 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine?
The canonical SMILES for 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine is CC(CC1CCC1)NCc1cccnn1.
What is the InChIKey of 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine?
The InChIKey is DQLIWXGOGDRIHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3/c1-10(8-11-4-2-5-11)13-9-12-6-3-7-14-15-12/h3,6-7,10-11,13H,2,4-5,8-9H2,1H3.
What are the key properties of 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine?
1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine has a molecular weight of 205.31 g/mol, XLogP of 2.14, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-(pyridazin-3-ylmethyl)propan-2-amine is sourced from PubChem (CID 106895211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).