2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol

C18H28N2O — CID 118745801

IUPAC2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol
SMILESCc1ccc2c(c1)C(N(C)C)CC21CCN(CCO)CC1
InChIInChI=1S/C18H28N2O/c1-14-4-5-16-15(12-14)17(19(2)3)13-18(16)6-8-20(9-7-18)10-11-21/h4-5,12,17,21H,6-11,13H2,1-3H3
InChIKeyARCFLLWYDGHUMS-UHFFFAOYSA-N
MW288.44 g/mol
LogP2.33
Rot. Bonds3

About 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol

2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol (PubChem CID 118745801) has the molecular formula C18H28N2O and a molecular weight of 288.44 g/mol. Its IUPAC name is 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol.

Molecular Properties

Compound Name2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol
PubChem CID118745801
Molecular FormulaC18H28N2O
Molecular Weight288.44 g/mol
Exact Mass288.22
IUPAC Name2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol
SMILESCc1ccc2c(c1)C(N(C)C)CC21CCN(CCO)CC1
InChIInChI=1S/C18H28N2O/c1-14-4-5-16-15(12-14)17(19(2)3)13-18(16)6-8-20(9-7-18)10-11-21/h4-5,12,17,21H,6-11,13H2,1-3H3
InChIKeyARCFLLWYDGHUMS-UHFFFAOYSA-N
XLogP2.33
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.44
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Tefludazine
CID 71240
2-{4-[6-Fluoro-3-(4-fluoro-phenyl)-indan-1-yl]-piperazin-1-yl}-ethanol
CID 10320519
2-{4-[3-(4-Fluoro-phenyl)-indan-1-yl]-piperazin-1-yl}-ethanol
CID 13154791
2-{4-[3-(4-Fluoro-phenyl)-6-methyl-indan-1-yl]-piperazin-1-yl}-ethanol
CID 13154795
2-{4-[3-(4-Fluoro-phenyl)-6-trifluoromethyl-indan-1-yl]-piperazin-1-yl}-ethanol
CID 4913274
2-[4-[(1S,3R)-3-(4-fluorophenyl)-6-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl]piperazin-1-yl]ethanol
CID 6917689
2-[4-[3-(4-fluorophenyl)-6-(trifluoromethyl)-2,3-dihydro-1H-inden-1-yl]piperazin-1-yl]ethanol;dihydrochloride
CID 11970897
2-{4-[5-Fluoro-3-(4-fluoro-phenyl)-indan-1-yl]-piperazin-1-yl}-ethanol
CID 13154792
2-{4-[3-(4-Fluoro-phenyl)-6-isopropyl-indan-1-yl]-piperazin-1-yl}-ethanol
CID 13154798
2-[4-(3-Phenyl-indan-1-yl)-piperazin-1-yl]-ethanol
CID 15115475
2-[4-(9H-fluoren-2-ylmethyl)-1-isopropyl-2-piperazinyl]ethanol
CID 16191866
2-[4-[3-(4-fluorophenyl)-6-methyl-2,3-dihydro-1H-inden-1-yl]piperazin-1-yl]ethanol;dihydrochloride
CID 52947781

Frequently Asked Questions

What is the IUPAC name of 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol?
The IUPAC name of 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol (CID 118745801) is 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol.
What is the SMILES notation for 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol?
The canonical SMILES for 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol is Cc1ccc2c(c1)C(N(C)C)CC21CCN(CCO)CC1.
What is the InChIKey of 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol?
The InChIKey is ARCFLLWYDGHUMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H28N2O/c1-14-4-5-16-15(12-14)17(19(2)3)13-18(16)6-8-20(9-7-18)10-11-21/h4-5,12,17,21H,6-11,13H2,1-3H3.
What are the key properties of 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol?
2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol has a molecular weight of 288.44 g/mol, XLogP of 2.33, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(dimethylamino)-6-methylspiro[1,2-dihydroindene-3,4'-piperidine]-1'-yl]ethanol is sourced from PubChem (CID 118745801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).