1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol

C11H23NO2 — CID 117019027

IUPAC1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol
SMILESCOCCCN1CCCC(O)C1(C)C
InChIInChI=1S/C11H23NO2/c1-11(2)10(13)6-4-7-12(11)8-5-9-14-3/h10,13H,4-9H2,1-3H3
InChIKeyHEAKIFUSWZUJSL-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.26
Rot. Bonds4

About 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol

1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol (PubChem CID 117019027) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol.

Molecular Properties

Compound Name1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol
PubChem CID117019027
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol
SMILESCOCCCN1CCCC(O)C1(C)C
InChIInChI=1S/C11H23NO2/c1-11(2)10(13)6-4-7-12(11)8-5-9-14-3/h10,13H,4-9H2,1-3H3
InChIKeyHEAKIFUSWZUJSL-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-ol
CID 117016800
[1-(3-methoxypropyl)-2,2-dimethylpyrrolidin-3-yl]methanamine
CID 117017613
1-(2-methoxyethyl)-N,2,2-trimethylpiperidin-3-amine
CID 117019270
[1-(3-methoxypropyl)-2,2-dimethylpiperidin-4-yl]methanol
CID 117020669
[1-(2-methoxyethyl)-2,2-dimethylpyrrolidin-3-yl]methanol
CID 117017703
1-(2-methoxyethyl)-2,2-dimethylpyrrolidine-3-carboxylic acid
CID 117017264
1-(3-methoxypropyl)-2,2-dimethylpiperidine-4-carbonitrile
CID 117020247
1-(5-methoxypentyl)piperidin-3-ol
CID 110932736
[(3R)-1-(3-methoxypropyl)piperidin-3-yl]methanol
CID 129367340
2-[1-(3-methoxypropyl)pyrrolidin-2-yl]-1-phenylethanol
CID 111490186
N-[[1-(3-methoxypropyl)pyrrolidin-2-yl]methyl]ethanamine
CID 62582162
2-(bromomethyl)-1-(4-methoxybutyl)pyrrolidine
CID 104649764

Frequently Asked Questions

What is the IUPAC name of 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol?
The IUPAC name of 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol (CID 117019027) is 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol.
What is the SMILES notation for 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol?
The canonical SMILES for 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol is COCCCN1CCCC(O)C1(C)C.
What is the InChIKey of 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol?
The InChIKey is HEAKIFUSWZUJSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-11(2)10(13)6-4-7-12(11)8-5-9-14-3/h10,13H,4-9H2,1-3H3.
What are the key properties of 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol?
1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol has a molecular weight of 201.31 g/mol, XLogP of 1.26, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-methoxypropyl)-2,2-dimethylpiperidin-3-ol is sourced from PubChem (CID 117019027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).