3-methoxy-6-piperidin-3-ylpyridazin-4-amine

C10H16N4O — CID 117105660

IUPAC3-methoxy-6-piperidin-3-ylpyridazin-4-amine
SMILESCOc1nnc(C2CCCNC2)cc1N
InChIInChI=1S/C10H16N4O/c1-15-10-8(11)5-9(13-14-10)7-3-2-4-12-6-7/h5,7,12H,2-4,6H2,1H3,(H2,11,13)
InChIKeyVBDPUMAQSVPCKT-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.53
Rot. Bonds2

About 3-methoxy-6-piperidin-3-ylpyridazin-4-amine

3-methoxy-6-piperidin-3-ylpyridazin-4-amine (PubChem CID 117105660) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-methoxy-6-piperidin-3-ylpyridazin-4-amine.

Molecular Properties

Compound Name3-methoxy-6-piperidin-3-ylpyridazin-4-amine
PubChem CID117105660
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name3-methoxy-6-piperidin-3-ylpyridazin-4-amine
SMILESCOc1nnc(C2CCCNC2)cc1N
InChIInChI=1S/C10H16N4O/c1-15-10-8(11)5-9(13-14-10)7-3-2-4-12-6-7/h5,7,12H,2-4,6H2,1H3,(H2,11,13)
InChIKeyVBDPUMAQSVPCKT-UHFFFAOYSA-N
XLogP0.53
TPSA73.06 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-cyclobutyl-3-methoxypyridazin-4-amine
CID 117127031
2-methoxy-3-methyl-5-piperidin-3-ylpyrazine
CID 83833851
6-(4,4-difluoropiperidin-3-yl)-3-methoxypyridazin-4-amine
CID 163237787
2-methoxy-3-piperidin-3-ylaniline
CID 174616983
2-methyl-5-piperidin-3-ylpyrazine
CID 82599606
4,5-dimethyl-2-piperidin-3-ylaniline
CID 166143865
4-methoxy-2-piperidin-3-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 105493352
2-methoxy-5-[(3R)-piperidin-3-yl]pyridine
CID 93478601
2-methoxy-6-methyl-4-piperidin-3-ylpyridine
CID 146284880
1-methoxy-6-piperidin-3-ylisoquinoline
CID 117358121
4,6-dimethyl-2-piperidin-3-ylpyrimidine
CID 63317441
3-(4-methoxyphenyl)piperidine
CID 12937920

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-6-piperidin-3-ylpyridazin-4-amine?
The IUPAC name of 3-methoxy-6-piperidin-3-ylpyridazin-4-amine (CID 117105660) is 3-methoxy-6-piperidin-3-ylpyridazin-4-amine.
What is the SMILES notation for 3-methoxy-6-piperidin-3-ylpyridazin-4-amine?
The canonical SMILES for 3-methoxy-6-piperidin-3-ylpyridazin-4-amine is COc1nnc(C2CCCNC2)cc1N.
What is the InChIKey of 3-methoxy-6-piperidin-3-ylpyridazin-4-amine?
The InChIKey is VBDPUMAQSVPCKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-15-10-8(11)5-9(13-14-10)7-3-2-4-12-6-7/h5,7,12H,2-4,6H2,1H3,(H2,11,13).
What are the key properties of 3-methoxy-6-piperidin-3-ylpyridazin-4-amine?
3-methoxy-6-piperidin-3-ylpyridazin-4-amine has a molecular weight of 208.26 g/mol, XLogP of 0.53, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-6-piperidin-3-ylpyridazin-4-amine is sourced from PubChem (CID 117105660), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).