6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine

C10H14F2N4O — CID 163237787

IUPAC6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine
SMILESCOc1nnc(C2CNCCC2(F)F)cc1N
InChIInChI=1S/C10H14F2N4O/c1-17-9-7(13)4-8(15-16-9)6-5-14-3-2-10(6,11)12/h4,6,14H,2-3,5H2,1H3,(H2,13,15)
InChIKeyWQZSLWNNWUBEQQ-UHFFFAOYSA-N
MW244.24 g/mol
LogP0.78
Rot. Bonds2

About 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine

6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine (PubChem CID 163237787) has the molecular formula C10H14F2N4O and a molecular weight of 244.24 g/mol. Its IUPAC name is 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine.

Molecular Properties

Compound Name6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine
PubChem CID163237787
Molecular FormulaC10H14F2N4O
Molecular Weight244.24 g/mol
Exact Mass244.11
IUPAC Name6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine
SMILESCOc1nnc(C2CNCCC2(F)F)cc1N
InChIInChI=1S/C10H14F2N4O/c1-17-9-7(13)4-8(15-16-9)6-5-14-3-2-10(6,11)12/h4,6,14H,2-3,5H2,1H3,(H2,13,15)
InChIKeyWQZSLWNNWUBEQQ-UHFFFAOYSA-N
XLogP0.78
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.24
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-methoxy-6-piperidin-3-ylpyridazin-4-amine
CID 117105660
6-cyclobutyl-3-methoxypyridazin-4-amine
CID 117127031
tert-butyl-[1-[5-(4,4-difluoropiperidin-3-yl)-2-methoxy-3-pyridinyl]-1,2,2-trifluoroethoxy]-dimethylsilane;dihydrochloride
CID 175468409
4,4-difluoro-3-(1-methylpyrazol-4-yl)piperidine;hydrochloride
CID 166561535
4,4-difluoro-3-(3-methylphenyl)piperidine
CID 84723273
4,4-difluoropiperidin-3-amine
CID 86775600
4-fluoro-3-(3-methoxyphenyl)-4-methylpiperidine
CID 84725231
3-methoxy-6-(2-methoxyphenyl)pyridazin-4-amine
CID 117127022
4-[(3S)-4,4-difluoropiperidin-3-yl]-1-hydroxypyridin-1-ium
CID 176950744
5-(4,4-difluoropiperidin-3-yl)-3-(methylsulfonylmethyl)-1H-pyridin-2-one
CID 164734624
4,4-difluoropiperidin-3-amine;hydrochloride
CID 121487885
2-(5-amino-6-methoxypyridazin-3-yl)ethanol
CID 117104987

Frequently Asked Questions

What is the IUPAC name of 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine?
The IUPAC name of 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine (CID 163237787) is 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine.
What is the SMILES notation for 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine?
The canonical SMILES for 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine is COc1nnc(C2CNCCC2(F)F)cc1N.
What is the InChIKey of 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine?
The InChIKey is WQZSLWNNWUBEQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14F2N4O/c1-17-9-7(13)4-8(15-16-9)6-5-14-3-2-10(6,11)12/h4,6,14H,2-3,5H2,1H3,(H2,13,15).
What are the key properties of 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine?
6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine has a molecular weight of 244.24 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine is sourced from PubChem (CID 163237787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).