2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol

C15H24N2O2 — CID 83208839

IUPAC2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol
SMILESCCN1CCOC(Cn2cc3c(c2)C(O)CCC3)C1
InChIInChI=1S/C15H24N2O2/c1-2-16-6-7-19-13(9-16)10-17-8-12-4-3-5-15(18)14(12)11-17/h8,11,13,15,18H,2-7,9-10H2,1H3
InChIKeyDGVIJRWVHHKNIQ-UHFFFAOYSA-N
MW264.37 g/mol
LogP1.58
Rot. Bonds3

About 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol

2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol (PubChem CID 83208839) has the molecular formula C15H24N2O2 and a molecular weight of 264.37 g/mol. Its IUPAC name is 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol.

Molecular Properties

Compound Name2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol
PubChem CID83208839
Molecular FormulaC15H24N2O2
Molecular Weight264.37 g/mol
Exact Mass264.18
IUPAC Name2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol
SMILESCCN1CCOC(Cn2cc3c(c2)C(O)CCC3)C1
InChIInChI=1S/C15H24N2O2/c1-2-16-6-7-19-13(9-16)10-17-8-12-4-3-5-15(18)14(12)11-17/h8,11,13,15,18H,2-7,9-10H2,1H3
InChIKeyDGVIJRWVHHKNIQ-UHFFFAOYSA-N
XLogP1.58
TPSA37.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.37
LogP ≤ 51.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(4-ethylmorpholin-2-yl)methyl]-N-methyl-4,5,6,7-tetrahydroisoindol-4-amine
CID 83214111
2-[(4-methylmorpholin-2-yl)methyl]-5,6,7,8-tetrahydro-4H-cyclohepta[c]pyrrol-4-ol
CID 83208559
2-[(5,5-dimethyloxolan-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol
CID 116522955
1-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroindol-4-amine
CID 114401128
2-(2-methoxyethyl)-4,5,6,7-tetrahydroisoindol-4-ol
CID 83208994
trans-(1S,2S)-2-[(4-ethylmorpholin-2-yl)methylamino]cyclohexan-1-ol
CID 102731765
5-[(4-hydroxy-4,5,6,7-tetrahydroisoindol-2-yl)methyl]pyrrolidin-2-one
CID 114281730
2-[(4-ethylmorpholin-2-yl)methyl]pyrazole-3-carboxylic acid
CID 79172074
[1-[(4-ethylmorpholin-2-yl)methyl]triazol-4-yl]methanol
CID 79183183
1-[(4-ethylmorpholin-2-yl)methyl]pyrrole-3-carbaldehyde
CID 79182621
1-[(4-ethylmorpholin-2-yl)methyl]pyrrole-2,5-dione
CID 114400408
2-[(3-chloropyrrolidin-1-yl)methyl]-4-ethylmorpholine
CID 79182491

Frequently Asked Questions

What is the IUPAC name of 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol?
The IUPAC name of 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol (CID 83208839) is 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol.
What is the SMILES notation for 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol?
The canonical SMILES for 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol is CCN1CCOC(Cn2cc3c(c2)C(O)CCC3)C1.
What is the InChIKey of 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol?
The InChIKey is DGVIJRWVHHKNIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O2/c1-2-16-6-7-19-13(9-16)10-17-8-12-4-3-5-15(18)14(12)11-17/h8,11,13,15,18H,2-7,9-10H2,1H3.
What are the key properties of 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol?
2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol has a molecular weight of 264.37 g/mol, XLogP of 1.58, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-ethylmorpholin-2-yl)methyl]-4,5,6,7-tetrahydroisoindol-4-ol is sourced from PubChem (CID 83208839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).