4,5-diethyl-2,5-dimethylthiomorpholine

C10H21NS — CID 163549722

IUPAC4,5-diethyl-2,5-dimethylthiomorpholine
SMILESCCN1CC(C)SCC1(C)CC
InChIInChI=1S/C10H21NS/c1-5-10(4)8-12-9(3)7-11(10)6-2/h9H,5-8H2,1-4H3
InChIKeyFIAZRDDWFNEDBG-UHFFFAOYSA-N
MW187.35 g/mol
LogP2.61
Rot. Bonds2

About 4,5-diethyl-2,5-dimethylthiomorpholine

4,5-diethyl-2,5-dimethylthiomorpholine (PubChem CID 163549722) has the molecular formula C10H21NS and a molecular weight of 187.35 g/mol. Its IUPAC name is 4,5-diethyl-2,5-dimethylthiomorpholine.

Molecular Properties

Compound Name4,5-diethyl-2,5-dimethylthiomorpholine
PubChem CID163549722
Molecular FormulaC10H21NS
Molecular Weight187.35 g/mol
Exact Mass187.14
IUPAC Name4,5-diethyl-2,5-dimethylthiomorpholine
SMILESCCN1CC(C)SCC1(C)CC
InChIInChI=1S/C10H21NS/c1-5-10(4)8-12-9(3)7-11(10)6-2/h9H,5-8H2,1-4H3
InChIKeyFIAZRDDWFNEDBG-UHFFFAOYSA-N
XLogP2.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.35
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,2-Dimethyl-4-(3-methylbutyl)thiomorpholine
CID 130726719
3-Tert-butyl-1,3-thiazinane
CID 12634521
3-Ethyl-2,4-dimethylthiomorpholine
CID 12517922
2-Methyl-3.4-diathyl-thiomorpholin
CID 12517923
4-(3-Fluoropropyl)-2,3-dimethylthiomorpholine
CID 127497755
4-(2-Fluorobutyl)-3,3-dimethylthiomorpholine
CID 130660531
4-(3-Fluorobutyl)-3,3-dimethylthiomorpholine
CID 130778394
2,3-Diethyl-1,3-thiazinane
CID 12634518
3-Ethyl-2-propan-2-yl-1,3-thiazinane
CID 12634519
4-Butyl-2-ethylthiomorpholine
CID 13356762
4-Ethyl-2,6-dimethylthiomorpholine
CID 12869168
4-Tert-butylthiomorpholine
CID 18343174

Frequently Asked Questions

What is the IUPAC name of 4,5-diethyl-2,5-dimethylthiomorpholine?
The IUPAC name of 4,5-diethyl-2,5-dimethylthiomorpholine (CID 163549722) is 4,5-diethyl-2,5-dimethylthiomorpholine.
What is the SMILES notation for 4,5-diethyl-2,5-dimethylthiomorpholine?
The canonical SMILES for 4,5-diethyl-2,5-dimethylthiomorpholine is CCN1CC(C)SCC1(C)CC.
What is the InChIKey of 4,5-diethyl-2,5-dimethylthiomorpholine?
The InChIKey is FIAZRDDWFNEDBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NS/c1-5-10(4)8-12-9(3)7-11(10)6-2/h9H,5-8H2,1-4H3.
What are the key properties of 4,5-diethyl-2,5-dimethylthiomorpholine?
4,5-diethyl-2,5-dimethylthiomorpholine has a molecular weight of 187.35 g/mol, XLogP of 2.61, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-diethyl-2,5-dimethylthiomorpholine is sourced from PubChem (CID 163549722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).