[2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone

C18H23NO3 — CID 71869875

IUPAC[2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone
SMILESCOCC1CN(C(=O)C2CC23CCc2ccccc23)CCO1
InChIInChI=1S/C18H23NO3/c1-21-12-14-11-19(8-9-22-14)17(20)16-10-18(16)7-6-13-4-2-3-5-15(13)18/h2-5,14,16H,6-12H2,1H3
InChIKeyPIXMJBOEBUQEEW-UHFFFAOYSA-N
MW301.39 g/mol
LogP1.76
Rot. Bonds3

About [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone

[2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone (PubChem CID 71869875) has the molecular formula C18H23NO3 and a molecular weight of 301.39 g/mol. Its IUPAC name is [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone.

Molecular Properties

Compound Name[2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone
PubChem CID71869875
Molecular FormulaC18H23NO3
Molecular Weight301.39 g/mol
Exact Mass301.17
IUPAC Name[2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone
SMILESCOCC1CN(C(=O)C2CC23CCc2ccccc23)CCO1
InChIInChI=1S/C18H23NO3/c1-21-12-14-11-19(8-9-22-14)17(20)16-10-18(16)7-6-13-4-2-3-5-15(13)18/h2-5,14,16H,6-12H2,1H3
InChIKeyPIXMJBOEBUQEEW-UHFFFAOYSA-N
XLogP1.76
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2,2-Diphenylcyclopropyl)(morpholin-4-yl)methanone
CID 661533
(Morpholin-4-yl)(1-phenylcyclopentyl)methanone
CID 760860
4-(3H-inden-1-yl)-1-morpholin-4-ylbutan-1-one
CID 46230958
Methanone, (2-indanyl)(4-morpholyl)-
CID 576078
2-[(2R*,6S*)-2,6-dimethyl-4-morpholinyl]-N,N-dimethyl-2-indanecarboxamide
CID 56886738
2-[5-Fluoro-1'-(2-methoxyethyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 118739125
N-cyclopropyl-2-[1'-(2-methoxyacetyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 118741226
[4-(2-Methoxyethoxy)piperidino](1-phenylcyclopropyl)methanone
CID 91918271
2,6-Dimethyl-4-(3-phenylbutanoyl)morpholine
CID 2914701
1-(2,6-Dimethylmorpholin-4-yl)-2-phenylbutan-1-one
CID 3858605
(3-Ethylmorpholin-4-yl)-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone
CID 71869729
9-[(1R)-2,3-dihydro-1H-indene-1-carbonyl]-2-(2-methoxyethyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 97124368

Frequently Asked Questions

What is the IUPAC name of [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone?
The IUPAC name of [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone (CID 71869875) is [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone.
What is the SMILES notation for [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone?
The canonical SMILES for [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone is COCC1CN(C(=O)C2CC23CCc2ccccc23)CCO1.
What is the InChIKey of [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone?
The InChIKey is PIXMJBOEBUQEEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23NO3/c1-21-12-14-11-19(8-9-22-14)17(20)16-10-18(16)7-6-13-4-2-3-5-15(13)18/h2-5,14,16H,6-12H2,1H3.
What are the key properties of [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone?
[2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone has a molecular weight of 301.39 g/mol, XLogP of 1.76, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(methoxymethyl)morpholin-4-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone is sourced from PubChem (CID 71869875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).