5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine

C18H29N3 — CID 102543179

IUPAC5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine
SMILESCCN1CCCCC1c1cnc(N2CCCCC2)cc1C
InChIInChI=1S/C18H29N3/c1-3-20-10-8-5-9-17(20)16-14-19-18(13-15(16)2)21-11-6-4-7-12-21/h13-14,17H,3-12H2,1-2H3
InChIKeyPVIZCTHGELKOQT-UHFFFAOYSA-N
MW287.45 g/mol
LogP3.93
Rot. Bonds3

About 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine

5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine (PubChem CID 102543179) has the molecular formula C18H29N3 and a molecular weight of 287.45 g/mol. Its IUPAC name is 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine.

Molecular Properties

Compound Name5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine
PubChem CID102543179
Molecular FormulaC18H29N3
Molecular Weight287.45 g/mol
Exact Mass287.24
IUPAC Name5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine
SMILESCCN1CCCCC1c1cnc(N2CCCCC2)cc1C
InChIInChI=1S/C18H29N3/c1-3-20-10-8-5-9-17(20)16-14-19-18(13-15(16)2)21-11-6-4-7-12-21/h13-14,17H,3-12H2,1-2H3
InChIKeyPVIZCTHGELKOQT-UHFFFAOYSA-N
XLogP3.93
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.45
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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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-methyl-5-(1-propan-2-ylpiperidin-2-yl)-2-pyrrolidin-1-ylpyridine
CID 102542989
4-[5-(1-benzylpiperidin-2-yl)-4-methyl-2-pyridinyl]morpholine
CID 102543280
benzyl 2-(4-methyl-6-piperidin-1-yl-3-pyridinyl)pyrrolidine-1-carboxylate
CID 102543168
4-[4-methyl-5-(1-methylpyrrolidin-2-yl)-2-pyridinyl]morpholine
CID 102543259
benzyl 2-(4-methyl-6-pyrrolidin-1-yl-3-pyridinyl)piperidine-1-carboxylate
CID 102542994
1-(5-bromo-4-methyl-2-pyridinyl)azepane
CID 53408181
4-[4-methyl-5-[(2S)-1-(4-methylphenyl)sulfonylpiperidin-2-yl]-2-pyridinyl]morpholine
CID 124500065
3-(1-ethylpyrrolidin-2-yl)-5-fluoro-2-methylpyridine
CID 129252823
(1S)-1-(4-methyl-6-pyrrolidin-1-yl-3-pyridinyl)ethanamine
CID 124501941
(1R)-1-[6-(azepan-1-yl)-4-methyl-3-pyridinyl]ethanamine
CID 124501966

Frequently Asked Questions

What is the IUPAC name of 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine?
The IUPAC name of 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine (CID 102543179) is 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine.
What is the SMILES notation for 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine?
The canonical SMILES for 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine is CCN1CCCCC1c1cnc(N2CCCCC2)cc1C.
What is the InChIKey of 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine?
The InChIKey is PVIZCTHGELKOQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29N3/c1-3-20-10-8-5-9-17(20)16-14-19-18(13-15(16)2)21-11-6-4-7-12-21/h13-14,17H,3-12H2,1-2H3.
What are the key properties of 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine?
5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine has a molecular weight of 287.45 g/mol, XLogP of 3.93, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-ethylpiperidin-2-yl)-4-methyl-2-piperidin-1-ylpyridine is sourced from PubChem (CID 102543179), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).