3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol

C11H23NO — CID 115872854

IUPAC3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol
SMILESCCC1CCN(CC(C)CO)CC1
InChIInChI=1S/C11H23NO/c1-3-11-4-6-12(7-5-11)8-10(2)9-13/h10-11,13H,3-9H2,1-2H3
InChIKeyTVCPHDFERNTILG-UHFFFAOYSA-N
MW185.31 g/mol
LogP1.74
Rot. Bonds4

About 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol

3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol (PubChem CID 115872854) has the molecular formula C11H23NO and a molecular weight of 185.31 g/mol. Its IUPAC name is 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol
PubChem CID115872854
Molecular FormulaC11H23NO
Molecular Weight185.31 g/mol
Exact Mass185.18
IUPAC Name3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol
SMILESCCC1CCN(CC(C)CO)CC1
InChIInChI=1S/C11H23NO/c1-3-11-4-6-12(7-5-11)8-10(2)9-13/h10-11,13H,3-9H2,1-2H3
InChIKeyTVCPHDFERNTILG-UHFFFAOYSA-N
XLogP1.74
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.31
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-[(3R)-3-aminopyrrolidin-1-yl]-2-methylpropan-1-ol
CID 104881569
3-(1-ethylpiperidin-4-yl)-2-methylpropan-1-ol
CID 83983052
3-(4,4-dimethylpiperidin-1-yl)-2-methylpropan-1-ol
CID 115872983
2-[(4-ethylpiperidin-1-yl)methyl]-3-methylbutan-1-amine
CID 65233237
ethane;2-(4-ethylpiperidin-1-yl)ethanol
CID 143029211
4-ethyl-1-(3-methylhexyl)piperidine
CID 176984647
3-(4-ethyl-4-methylpiperidin-1-yl)-2-methylpropan-1-ol
CID 115872959
[1-(2-methyl-3-pyrrolidin-1-ylpropyl)pyrrolidin-3-yl]methanol
CID 64867957
3-(4-ethylazepan-1-yl)-2-(propylamino)propan-1-ol
CID 64811056
3-amino-4-(4-ethylazepan-1-yl)butan-1-ol
CID 64898347
2-(4-ethylpiperidin-1-yl)-1-(4-propan-2-ylphenyl)ethanol
CID 60970237
2-methyl-3-(1-propylpyrrolidin-3-yl)propan-1-ol
CID 83981032

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol?
The IUPAC name of 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol (CID 115872854) is 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol?
The canonical SMILES for 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol is CCC1CCN(CC(C)CO)CC1.
What is the InChIKey of 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol?
The InChIKey is TVCPHDFERNTILG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO/c1-3-11-4-6-12(7-5-11)8-10(2)9-13/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol?
3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol has a molecular weight of 185.31 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylpiperidin-1-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 115872854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).