6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol

C12H25NO2 — CID 103737990

IUPAC6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol
SMILESCOCC1CCN(CCCCCCO)C1
InChIInChI=1S/C12H25NO2/c1-15-11-12-6-8-13(10-12)7-4-2-3-5-9-14/h12,14H,2-11H2,1H3
InChIKeyMOTRVMNJRBABQX-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.51
Rot. Bonds8

About 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol

6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol (PubChem CID 103737990) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol.

Molecular Properties

Compound Name6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol
PubChem CID103737990
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol
SMILESCOCC1CCN(CCCCCCO)C1
InChIInChI=1S/C12H25NO2/c1-15-11-12-6-8-13(10-12)7-4-2-3-5-9-14/h12,14H,2-11H2,1H3
InChIKeyMOTRVMNJRBABQX-UHFFFAOYSA-N
XLogP1.51
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.51
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

7-[3-(methoxymethyl)pyrrolidin-1-yl]heptan-1-amine
CID 64599167
6-(3-ethylpyrrolidin-1-yl)hexan-1-ol
CID 103748114
6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-2-ol
CID 64597053
6-[3-(aminomethyl)pyrrolidin-1-yl]hexan-1-ol
CID 103815424
6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-2-amine
CID 64570092
5-[3-(methoxymethyl)pyrrolidin-1-yl]pentan-2-amine
CID 64570689
1-(2-iodoethyl)-3-(methoxymethyl)pyrrolidine
CID 131222845
3-(3-ethylpyrrolidin-1-yl)propan-1-ol
CID 67281983
4-[3-(ethoxymethyl)piperidin-1-yl]butan-1-ol
CID 111148113
6-[4-(hydroxymethyl)piperidin-1-yl]hexan-1-ol
CID 103737785
6-[3-(methoxymethyl)piperidin-1-yl]hexane-1-thiol
CID 106590054
6-[3-(methoxymethyl)piperidin-1-yl]hexan-1-amine
CID 106587405

Frequently Asked Questions

What is the IUPAC name of 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol?
The IUPAC name of 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol (CID 103737990) is 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol.
What is the SMILES notation for 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol?
The canonical SMILES for 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol is COCC1CCN(CCCCCCO)C1.
What is the InChIKey of 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol?
The InChIKey is MOTRVMNJRBABQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-15-11-12-6-8-13(10-12)7-4-2-3-5-9-14/h12,14H,2-11H2,1H3.
What are the key properties of 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol?
6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol has a molecular weight of 215.34 g/mol, XLogP of 1.51, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(methoxymethyl)pyrrolidin-1-yl]hexan-1-ol is sourced from PubChem (CID 103737990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).