3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine

C20H33N3O — CID 95228930

IUPAC3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine
SMILESCC1(C)CC(N2CCC[C@H](OCc3cccnc3)C2)CC(C)(C)N1
InChIInChI=1S/C20H33N3O/c1-19(2)11-17(12-20(3,4)22-19)23-10-6-8-18(14-23)24-15-16-7-5-9-21-13-16/h5,7,9,13,17-18,22H,6,8,10-12,14-15H2,1-4H3/t18-/m0/s1
InChIKeyLSLRTFMXGCNZLU-SFHVURJKSA-N
MW331.50 g/mol
LogP3.37
Rot. Bonds4

About 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine

3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine (PubChem CID 95228930) has the molecular formula C20H33N3O and a molecular weight of 331.50 g/mol. Its IUPAC name is 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine.

Molecular Properties

Compound Name3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine
PubChem CID95228930
Molecular FormulaC20H33N3O
Molecular Weight331.50 g/mol
Exact Mass331.26
IUPAC Name3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine
SMILESCC1(C)CC(N2CCC[C@H](OCc3cccnc3)C2)CC(C)(C)N1
InChIInChI=1S/C20H33N3O/c1-19(2)11-17(12-20(3,4)22-19)23-10-6-8-18(14-23)24-15-16-7-5-9-21-13-16/h5,7,9,13,17-18,22H,6,8,10-12,14-15H2,1-4H3/t18-/m0/s1
InChIKeyLSLRTFMXGCNZLU-SFHVURJKSA-N
XLogP3.37
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.50
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine with MolForge

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Related Compounds

3-[[1-[(5-cyclopropyl-1-methylpyrazol-4-yl)methyl]piperidin-3-yl]oxymethyl]pyridine
CID 56913051
3-ethylsulfanyl-1-[3-(pyridin-3-ylmethoxy)piperidin-1-yl]propan-1-one
CID 91775544
3-[[(3S)-1-[[3-(pyrazol-1-ylmethyl)phenyl]methyl]piperidin-3-yl]oxymethyl]pyridine
CID 95722499
5-(methylsulfanylmethyl)-2-[(3R)-3-(pyridin-3-ylmethoxy)piperidin-1-yl]pyridine
CID 96574780
4-methyl-6-[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-yl]pyrimidin-2-amine
CID 39817678
N,N-dimethyl-5-[[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-yl]methyl]pyridin-2-amine
CID 95714836
5-[[3-(pyridin-3-ylmethoxy)piperidin-1-yl]methyl]-2,1,3-benzoxadiazole
CID 56907304
3-[(4-methylcyclohexyl)oxymethyl]pyridine
CID 142207375
2,1-benzoxazol-3-yl-[(3R)-3-(pyridin-3-ylmethoxy)piperidin-1-yl]methanone
CID 95207327
5-methyl-3-[[3-(pyridin-3-ylmethoxy)piperidin-1-yl]methyl]-1H-indole
CID 56711543
N,N,5-trimethyl-2-[(3S)-3-(pyridin-3-ylmethoxy)piperidin-1-yl]pyrimidin-4-amine
CID 95128247
3-(4-methylpiperazin-1-yl)-1-[3-(pyridin-3-ylmethoxy)piperidin-1-yl]propan-1-one
CID 90648429

Frequently Asked Questions

What is the IUPAC name of 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine?
The IUPAC name of 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine (CID 95228930) is 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine.
What is the SMILES notation for 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine?
The canonical SMILES for 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine is CC1(C)CC(N2CCC[C@H](OCc3cccnc3)C2)CC(C)(C)N1.
What is the InChIKey of 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine?
The InChIKey is LSLRTFMXGCNZLU-SFHVURJKSA-N. The full InChI is InChI=1S/C20H33N3O/c1-19(2)11-17(12-20(3,4)22-19)23-10-6-8-18(14-23)24-15-16-7-5-9-21-13-16/h5,7,9,13,17-18,22H,6,8,10-12,14-15H2,1-4H3/t18-/m0/s1.
What are the key properties of 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine?
3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine has a molecular weight of 331.50 g/mol, XLogP of 3.37, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[(3S)-1-(2,2,6,6-tetramethylpiperidin-4-yl)piperidin-3-yl]oxymethyl]pyridine is sourced from PubChem (CID 95228930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).