6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine

C10H16FN5 — CID 134405844

IUPAC6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine
SMILESCN[C@@H]1CCN(c2ccc(N)nn2)C[C@H]1F
InChIInChI=1S/C10H16FN5/c1-13-8-4-5-16(6-7(8)11)10-3-2-9(12)14-15-10/h2-3,7-8,13H,4-6H2,1H3,(H2,12,14)/t7-,8-/m1/s1
InChIKeyVQBJJKZPZDCKPI-HTQZYQBOSA-N
MW225.27 g/mol
LogP0.19
Rot. Bonds2

About 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine

6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine (PubChem CID 134405844) has the molecular formula C10H16FN5 and a molecular weight of 225.27 g/mol. Its IUPAC name is 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine.

Molecular Properties

Compound Name6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine
PubChem CID134405844
Molecular FormulaC10H16FN5
Molecular Weight225.27 g/mol
Exact Mass225.14
IUPAC Name6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine
SMILESCN[C@@H]1CCN(c2ccc(N)nn2)C[C@H]1F
InChIInChI=1S/C10H16FN5/c1-13-8-4-5-16(6-7(8)11)10-3-2-9(12)14-15-10/h2-3,7-8,13H,4-6H2,1H3,(H2,12,14)/t7-,8-/m1/s1
InChIKeyVQBJJKZPZDCKPI-HTQZYQBOSA-N
XLogP0.19
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.27
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-(pyridazin-3-yl)piperidin-4-amine
CID 54594801
(3R)-N-methyl-1-(pyridazin-3-yl)piperidin-3-amine
CID 94476470
3,6-Di-1-piperidinylpyridazine
CID 6401556
N,N-dimethyl-6-(piperazin-1-yl)pyridazin-3-amine
CID 33702672
1-(Pyridazin-3-yl)piperidin-3-amine dihydrochloride
CID 54593918
N-methyl-N-(piperidin-4-yl)pyridazin-3-amine dihydrobromide
CID 54593964
3-(2-Methylpiperidin-1-yl)-6-(piperazin-1-yl)pyridazine
CID 76145082
N-(1-cyclopropylpiperidin-4-yl)tetrazolo[1,5-b]pyridazin-6-amine
CID 26043550
N-[3-(2-methylpiperidin-1-yl)propyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 42930313
N-[1-(2-methylpropyl)piperidin-4-yl]tetrazolo[1,5-b]pyridazin-6-amine
CID 52171012
N-Methyl-N-(piperidin-4-yl)pyridazin-3-amine
CID 54593965
N-[[(2R)-1-butylpiperidin-2-yl]methyl]tetrazolo[1,5-b]pyridazin-6-amine
CID 94795523

Frequently Asked Questions

What is the IUPAC name of 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine?
The IUPAC name of 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine (CID 134405844) is 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine.
What is the SMILES notation for 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine?
The canonical SMILES for 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine is CN[C@@H]1CCN(c2ccc(N)nn2)C[C@H]1F.
What is the InChIKey of 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine?
The InChIKey is VQBJJKZPZDCKPI-HTQZYQBOSA-N. The full InChI is InChI=1S/C10H16FN5/c1-13-8-4-5-16(6-7(8)11)10-3-2-9(12)14-15-10/h2-3,7-8,13H,4-6H2,1H3,(H2,12,14)/t7-,8-/m1/s1.
What are the key properties of 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine?
6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine has a molecular weight of 225.27 g/mol, XLogP of 0.19, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(3R,4R)-3-fluoro-4-(methylamino)piperidin-1-yl]pyridazin-3-amine is sourced from PubChem (CID 134405844), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).