4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine

C22H29N3O — CID 102543280

IUPAC4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine
SMILESCc1cc(N2CCOCC2)ncc1C1CCCCN1Cc1ccccc1
InChIInChI=1S/C22H29N3O/c1-18-15-22(24-11-13-26-14-12-24)23-16-20(18)21-9-5-6-10-25(21)17-19-7-3-2-4-8-19/h2-4,7-8,15-16,21H,5-6,9-14,17H2,1H3
InChIKeyPWFHRXNKDUNQHX-UHFFFAOYSA-N
MW351.49 g/mol
LogP3.95
Rot. Bonds4

About 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine

4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine (PubChem CID 102543280) has the molecular formula C22H29N3O and a molecular weight of 351.49 g/mol. Its IUPAC name is 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine.

Molecular Properties

Compound Name4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine
PubChem CID102543280
Molecular FormulaC22H29N3O
Molecular Weight351.49 g/mol
Exact Mass351.23
IUPAC Name4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine
SMILESCc1cc(N2CCOCC2)ncc1C1CCCCN1Cc1ccccc1
InChIInChI=1S/C22H29N3O/c1-18-15-22(24-11-13-26-14-12-24)23-16-20(18)21-9-5-6-10-25(21)17-19-7-3-2-4-8-19/h2-4,7-8,15-16,21H,5-6,9-14,17H2,1H3
InChIKeyPWFHRXNKDUNQHX-UHFFFAOYSA-N
XLogP3.95
TPSA28.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.49
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyrrolidin-1-ylpyridine
CID 102542992
5-(1-benzylpyrrolidin-2-yl)-4-methyl-2-pyrrolidin-1-ylpyridine
CID 102542973
4-[4-methyl-5-(1-methylpyrrolidin-2-yl)-2-pyridinyl]morpholine
CID 102543259
5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine
CID 102543179
4-[4-methyl-5-[(2S)-1-(4-methylphenyl)sulfonylpiperidin-2-yl]-2-pyridinyl]morpholine
CID 124500065
benzyl 2-(4-methyl-6-pyrrolidin-1-yl-3-pyridinyl)piperidine-1-carboxylate
CID 102542994
5-(1-benzylpiperidin-2-yl)-2-piperidin-1-ylpyridine
CID 102541519
benzyl 2-(4-methyl-6-piperidin-1-yl-3-pyridinyl)pyrrolidine-1-carboxylate
CID 102543168
2-(1-benzylpiperidin-2-yl)-3-methylpyridine
CID 102539039
3-(1-benzylpiperidin-2-yl)-2-(2,5-dimethylpyrrol-1-yl)pyridine
CID 102541932
4-methyl-5-(1-propan-2-ylpiperidin-2-yl)-2-pyrrolidin-1-ylpyridine
CID 102542989
5-[(2S)-1-benzylpiperidin-2-yl]-3-methyl-1,2,4-oxadiazole
CID 95051321

Frequently Asked Questions

What is the IUPAC name of 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine?
The IUPAC name of 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine (CID 102543280) is 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine.
What is the SMILES notation for 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine?
The canonical SMILES for 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine is Cc1cc(N2CCOCC2)ncc1C1CCCCN1Cc1ccccc1.
What is the InChIKey of 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine?
The InChIKey is PWFHRXNKDUNQHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O/c1-18-15-22(24-11-13-26-14-12-24)23-16-20(18)21-9-5-6-10-25(21)17-19-7-3-2-4-8-19/h2-4,7-8,15-16,21H,5-6,9-14,17H2,1H3.
What are the key properties of 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine?
4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine has a molecular weight of 351.49 g/mol, XLogP of 3.95, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine is sourced from PubChem (CID 102543280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).