4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine

C21H33N3O2 — CID 156719597

IUPAC4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine
SMILESCc1ccnc(OC2CC(OC3CCN(CC4CCNCC4)CC3)C2)c1
InChIInChI=1S/C21H33N3O2/c1-16-2-9-23-21(12-16)26-20-13-19(14-20)25-18-5-10-24(11-6-18)15-17-3-7-22-8-4-17/h2,9,12,17-20,22H,3-8,10-11,13-15H2,1H3
InChIKeyOTLVETIKFLXQGF-UHFFFAOYSA-N
MW359.51 g/mol
LogP2.78
Rot. Bonds6

About 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine

4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine (PubChem CID 156719597) has the molecular formula C21H33N3O2 and a molecular weight of 359.51 g/mol. Its IUPAC name is 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine.

Molecular Properties

Compound Name4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine
PubChem CID156719597
Molecular FormulaC21H33N3O2
Molecular Weight359.51 g/mol
Exact Mass359.26
IUPAC Name4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine
SMILESCc1ccnc(OC2CC(OC3CCN(CC4CCNCC4)CC3)C2)c1
InChIInChI=1S/C21H33N3O2/c1-16-2-9-23-21(12-16)26-20-13-19(14-20)25-18-5-10-24(11-6-18)15-17-3-7-22-8-4-17/h2,9,12,17-20,22H,3-8,10-11,13-15H2,1H3
InChIKeyOTLVETIKFLXQGF-UHFFFAOYSA-N
XLogP2.78
TPSA46.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.51
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine with MolForge

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Related Compounds

4-(2,5-dimethylphenoxy)-1-(piperidin-4-ylmethyl)piperidine;hydrochloride
CID 119930875
4-cyclohexyloxy-1-(piperidin-4-ylmethyl)piperidine
CID 119931133
ethane;4-methyl-2-[1-(2,2,2-trifluoroethyl)piperidin-4-yl]oxypyridine
CID 144655486
4-methyl-2-[(3R)-pyrrolidin-3-yl]oxypyridine;hydrochloride
CID 71638571
2-cyclopentyloxy-4-methylpyridine
CID 18779821
1-ethyl-4-[[1-[[3-[(4-propan-2-yl-2-pyridinyl)oxy]cyclobutyl]methyl]piperidin-4-yl]methyl]piperazine
CID 156558141
4-(4-chloro-3-methylphenoxy)-1-(piperidin-4-ylmethyl)piperidine
CID 69260286
4-[(4-methyl-2-pyridinyl)oxy]-1-oxa-9-azaspiro[5.5]undecane
CID 176515540
4-(4-methylpiperidin-1-yl)-2-[1-[(1-methylpiperidin-4-yl)methyl]piperidin-4-yl]oxypyridine
CID 170180705
2-N-[3-[(4-tert-butyl-2-pyridinyl)oxy]cyclobutyl]-5-N-[3-[1-[5-[[3-[1-(2,2-dimethylpropyl)piperidin-4-yl]oxycyclobutyl]amino]-2,2,5-trimethylhexyl]piperidin-4-yl]oxycyclobutyl]-2,5-dimethylhexane-2,5-diamine
CID 146339949
4-ethoxy-6-piperidin-4-yloxypyrimidine
CID 66320800
4-[1-(piperidin-4-ylmethyl)piperidin-4-yl]pyridine
CID 18328928

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine?
The IUPAC name of 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine (CID 156719597) is 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine.
What is the SMILES notation for 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine?
The canonical SMILES for 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine is Cc1ccnc(OC2CC(OC3CCN(CC4CCNCC4)CC3)C2)c1.
What is the InChIKey of 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine?
The InChIKey is OTLVETIKFLXQGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H33N3O2/c1-16-2-9-23-21(12-16)26-20-13-19(14-20)25-18-5-10-24(11-6-18)15-17-3-7-22-8-4-17/h2,9,12,17-20,22H,3-8,10-11,13-15H2,1H3.
What are the key properties of 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine?
4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine has a molecular weight of 359.51 g/mol, XLogP of 2.78, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-[3-[1-(piperidin-4-ylmethyl)piperidin-4-yl]oxycyclobutyl]oxypyridine is sourced from PubChem (CID 156719597), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).