5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine

C19H21NS — CID 66229931

IUPAC5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine
SMILESCC1(C)CSCC(c2ccc3c(c2)Cc2ccccc2-3)N1
InChIInChI=1S/C19H21NS/c1-19(2)12-21-11-18(20-19)14-7-8-17-15(10-14)9-13-5-3-4-6-16(13)17/h3-8,10,18,20H,9,11-12H2,1-2H3
InChIKeyGLPJDCYXHZEIRB-UHFFFAOYSA-N
MW295.45 g/mol
LogP4.41
Rot. Bonds1

About 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine

5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine (PubChem CID 66229931) has the molecular formula C19H21NS and a molecular weight of 295.45 g/mol. Its IUPAC name is 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine.

Molecular Properties

Compound Name5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine
PubChem CID66229931
Molecular FormulaC19H21NS
Molecular Weight295.45 g/mol
Exact Mass295.14
IUPAC Name5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine
SMILESCC1(C)CSCC(c2ccc3c(c2)Cc2ccccc2-3)N1
InChIInChI=1S/C19H21NS/c1-19(2)12-21-11-18(20-19)14-7-8-17-15(10-14)9-13-5-3-4-6-16(13)17/h3-8,10,18,20H,9,11-12H2,1-2H3
InChIKeyGLPJDCYXHZEIRB-UHFFFAOYSA-N
XLogP4.41
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.45
LogP ≤ 54.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(9H-fluoren-2-yl)piperazine
CID 171194655
(3S)-3-(9H-fluoren-2-yl)morpholine
CID 171193402
2-cyclobutyl-6,12-dihydroindeno[1,2-b]fluorene
CID 59801079
5-(2-ethoxyphenyl)-3,3-dimethylthiomorpholine
CID 66229689
nonacyclo[18.14.0.03,18.04,16.06,14.08,13.021,33.023,31.025,30]tetratriaconta-1,3(18),4(16),5,8,10,12,14,19,21(33),22,25,27,29,31-pentadecaene
CID 59863436
2-(9H-fluoren-3-yl)-9,9-dimethylfluorene
CID 144953405
1,1,2,2,3,3-hexamethyl-9H-cyclopenta[b]fluorene
CID 145257374
2-[2-(4,5-dimethyl-1,3-dithiol-2-ylidene)-1,2-bis(9H-fluoren-2-yl)ethylidene]-4,5-dimethyl-1,3-dithiole
CID 101055689
9H-fluorene;oxophosphane
CID 174601741
9H-fluorene;trihydrofluoride
CID 172854917
cadmium;9H-fluorene
CID 175337736
azane;hexakis(9H-fluorene)
CID 158472914

Frequently Asked Questions

What is the IUPAC name of 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine?
The IUPAC name of 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine (CID 66229931) is 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine.
What is the SMILES notation for 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine?
The canonical SMILES for 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine is CC1(C)CSCC(c2ccc3c(c2)Cc2ccccc2-3)N1.
What is the InChIKey of 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine?
The InChIKey is GLPJDCYXHZEIRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NS/c1-19(2)12-21-11-18(20-19)14-7-8-17-15(10-14)9-13-5-3-4-6-16(13)17/h3-8,10,18,20H,9,11-12H2,1-2H3.
What are the key properties of 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine?
5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine has a molecular weight of 295.45 g/mol, XLogP of 4.41, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(9H-fluoren-2-yl)-3,3-dimethylthiomorpholine is sourced from PubChem (CID 66229931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).