[6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine

C11H18N4O — CID 64581391

IUPAC[6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine
SMILESCOCC1CCN(c2ccc(CN)nn2)C1
InChIInChI=1S/C11H18N4O/c1-16-8-9-4-5-15(7-9)11-3-2-10(6-12)13-14-11/h2-3,9H,4-8,12H2,1H3
InChIKeyZRWGPXHYXPOOPM-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.41
Rot. Bonds4

About [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine

[6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine (PubChem CID 64581391) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine
PubChem CID64581391
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC Name[6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine
SMILESCOCC1CCN(c2ccc(CN)nn2)C1
InChIInChI=1S/C11H18N4O/c1-16-8-9-4-5-15(7-9)11-3-2-10(6-12)13-14-11/h2-3,9H,4-8,12H2,1H3
InChIKeyZRWGPXHYXPOOPM-UHFFFAOYSA-N
XLogP0.41
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[(3R)-1-(6-methylpyridazin-3-yl)pyrrolidin-3-yl]methanamine
CID 94342238
[2-[3-(methoxymethyl)pyrrolidin-1-yl]-1,3-thiazol-4-yl]methanamine
CID 64581632
4-[3-(methoxymethyl)pyrrolidin-1-yl]pyrimidin-2-amine
CID 80845282
methyl 6-[3-(aminomethyl)pyrrolidin-1-yl]pyridazine-3-carboxylate
CID 62063099
[(3S)-1-(6-chloropyridazin-3-yl)pyrrolidin-3-yl]methanamine
CID 94342103
6-[(3S)-3-(methoxymethyl)pyrrolidin-1-yl]pyridine-3-carboxylic acid
CID 129371025
2-[1-(6-propylpyridazin-3-yl)piperidin-4-yl]ethanamine
CID 116972543
[6-(2-ethylmorpholin-4-yl)pyridazin-3-yl]methanamine
CID 62284627
[2-[4-(methoxymethyl)piperidin-1-yl]-4-pyridinyl]methanamine
CID 63971086
[2-[3-(methoxymethyl)pyrrolidin-1-yl]-1,3-thiazol-5-yl]methanamine
CID 64581617
6-[(3S)-3-(methoxymethyl)piperidin-1-yl]pyridin-3-amine
CID 129414410
[6-(4-ethylpiperidin-1-yl)pyridazin-3-yl]methanol
CID 61421696

Frequently Asked Questions

What is the IUPAC name of [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine?
The IUPAC name of [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine (CID 64581391) is [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine?
The canonical SMILES for [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine is COCC1CCN(c2ccc(CN)nn2)C1.
What is the InChIKey of [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine?
The InChIKey is ZRWGPXHYXPOOPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-16-8-9-4-5-15(7-9)11-3-2-10(6-12)13-14-11/h2-3,9H,4-8,12H2,1H3.
What are the key properties of [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine?
[6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine has a molecular weight of 222.29 g/mol, XLogP of 0.41, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[3-(methoxymethyl)pyrrolidin-1-yl]pyridazin-3-yl]methanamine is sourced from PubChem (CID 64581391), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).