6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine

C12H20N4 — CID 83838052

IUPAC6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
SMILESCC(C)c1ccc(NCC2CCCN2)nn1
InChIInChI=1S/C12H20N4/c1-9(2)11-5-6-12(16-15-11)14-8-10-4-3-7-13-10/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,14,16)
InChIKeyYJIVASDUNQVIFI-UHFFFAOYSA-N
MW220.32 g/mol
LogP1.76
Rot. Bonds4

About 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine

6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine (PubChem CID 83838052) has the molecular formula C12H20N4 and a molecular weight of 220.32 g/mol. Its IUPAC name is 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine.

Molecular Properties

Compound Name6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
PubChem CID83838052
Molecular FormulaC12H20N4
Molecular Weight220.32 g/mol
Exact Mass220.17
IUPAC Name6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
SMILESCC(C)c1ccc(NCC2CCCN2)nn1
InChIInChI=1S/C12H20N4/c1-9(2)11-5-6-12(16-15-11)14-8-10-4-3-7-13-10/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,14,16)
InChIKeyYJIVASDUNQVIFI-UHFFFAOYSA-N
XLogP1.76
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 51.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(5-methylfuran-2-yl)-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine
CID 116971067
5-fluoro-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 62542199
5-bromo-N-(pyrrolidin-2-ylmethyl)pyridin-2-amine
CID 62542194
3-methyl-2-[6-[[(2S)-pyrrolidin-2-yl]methylamino]pyridazin-3-yl]-5-(trifluoromethyl)phenol
CID 155284840
3,5-dimethyl-2-[6-[[(2R)-piperidin-2-yl]methylamino]pyridazin-3-yl]phenol
CID 162198494
2-cyclopropyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine
CID 83836780
3-methyl-2-[6-[[(2S)-piperidin-2-yl]methylamino]pyridazin-3-yl]-5-(trifluoromethyl)phenol
CID 155284642
N,N-dimethyl-6-(pyrrolidin-2-ylmethylamino)pyridine-3-sulfonamide
CID 103341110
N-(piperidin-2-ylmethyl)-5,7-dihydrofuro[3,4-b]pyridin-2-amine
CID 83841237
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]-6-(trifluoromethyl)pyridazin-3-amine
CID 104973215
2-methylsulfanyl-N-(pyrrolidin-2-ylmethyl)pyrimidin-4-amine;hydrochloride
CID 71643330
2,3,5,6-tetramethyl-N-(pyrrolidin-2-ylmethyl)aniline
CID 115208055

Frequently Asked Questions

What is the IUPAC name of 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The IUPAC name of 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine (CID 83838052) is 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine.
What is the SMILES notation for 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The canonical SMILES for 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine is CC(C)c1ccc(NCC2CCCN2)nn1.
What is the InChIKey of 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
The InChIKey is YJIVASDUNQVIFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N4/c1-9(2)11-5-6-12(16-15-11)14-8-10-4-3-7-13-10/h5-6,9-10,13H,3-4,7-8H2,1-2H3,(H,14,16).
What are the key properties of 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine?
6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine has a molecular weight of 220.32 g/mol, XLogP of 1.76, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pyridazin-3-amine is sourced from PubChem (CID 83838052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).