(2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol

C10H19NO2 — CID 177033202

IUPAC(2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol
SMILESCCOCC12CCCN1C[C@H](O)C2
InChIInChI=1S/C10H19NO2/c1-2-13-8-10-4-3-5-11(10)7-9(12)6-10/h9,12H,2-8H2,1H3/t9-,10?/m1/s1
InChIKeyLGBVFWUJGQVMRE-YHMJZVADSA-N
MW185.27 g/mol
LogP0.62
Rot. Bonds3

About (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol

(2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol (PubChem CID 177033202) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol.

Molecular Properties

Compound Name(2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol
PubChem CID177033202
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Name(2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol
SMILESCCOCC12CCCN1C[C@H](O)C2
InChIInChI=1S/C10H19NO2/c1-2-13-8-10-4-3-5-11(10)7-9(12)6-10/h9,12H,2-8H2,1H3/t9-,10?/m1/s1
InChIKeyLGBVFWUJGQVMRE-YHMJZVADSA-N
XLogP0.62
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

8a-(ethoxymethyl)-2-methyl-1,3,4,6,7,8-hexahydropyrrolo[1,2-a]pyrazine
CID 176568096
8-(ethoxymethyl)-3,5,6,7-tetrahydro-1H-pyrrolizin-2-one
CID 170411839
(2S,8R)-2-fluoro-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 164878427
(2R,8R)-2-fluoro-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 164903949
ethane;(2R,8R)-2-methoxy-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 164904163
ethane;(2R,8S)-2-fluoro-8-(methoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 177010029
(2R,8S)-2-methyl-8-(propan-2-yloxymethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 167196327
(Z,8S)-8-(ethoxymethyl)-N-methoxy-3,5,6,7-tetrahydro-1H-pyrrolizin-2-imine
CID 176663573
ethane;8-(ethoxymethyl)-2,6-dimethylidene-1,3,5,7-tetrahydropyrrolizine;8-(ethoxymethyl)-6-methylidene-2,3,5,7-tetrahydro-1H-pyrrolizine
CID 176926604
(3S,8S)-8-(ethoxymethyl)-3-(fluoromethyl)-1,2,3,5,6,7-hexahydropyrrolizine
CID 169255735
[(3S,8R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-3-yl]methanamine
CID 177217439
O-[[(2S,8S)-2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl]methyl]hydroxylamine
CID 176690420

Frequently Asked Questions

What is the IUPAC name of (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol?
The IUPAC name of (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol (CID 177033202) is (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol.
What is the SMILES notation for (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol?
The canonical SMILES for (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol is CCOCC12CCCN1C[C@H](O)C2.
What is the InChIKey of (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol?
The InChIKey is LGBVFWUJGQVMRE-YHMJZVADSA-N. The full InChI is InChI=1S/C10H19NO2/c1-2-13-8-10-4-3-5-11(10)7-9(12)6-10/h9,12H,2-8H2,1H3/t9-,10?/m1/s1.
What are the key properties of (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol?
(2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol has a molecular weight of 185.27 g/mol, XLogP of 0.62, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-8-(ethoxymethyl)-1,2,3,5,6,7-hexahydropyrrolizin-2-ol is sourced from PubChem (CID 177033202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).