4-(2-naphthalen-1-yloxyethyl)thiomorpholine

C16H19NOS — CID 48568928

IUPAC4-(2-naphthalen-1-yloxyethyl)thiomorpholine
SMILESc1ccc2c(OCCN3CCSCC3)cccc2c1
InChIInChI=1S/C16H19NOS/c1-2-6-15-14(4-1)5-3-7-16(15)18-11-8-17-9-12-19-13-10-17/h1-7H,8-13H2
InChIKeyMETUNFIMGSWKCY-UHFFFAOYSA-N
MW273.40 g/mol
LogP3.27
Rot. Bonds4

About 4-(2-naphthalen-1-yloxyethyl)thiomorpholine

4-(2-naphthalen-1-yloxyethyl)thiomorpholine (PubChem CID 48568928) has the molecular formula C16H19NOS and a molecular weight of 273.40 g/mol. Its IUPAC name is 4-(2-naphthalen-1-yloxyethyl)thiomorpholine.

Molecular Properties

Compound Name4-(2-naphthalen-1-yloxyethyl)thiomorpholine
PubChem CID48568928
Molecular FormulaC16H19NOS
Molecular Weight273.40 g/mol
Exact Mass273.12
IUPAC Name4-(2-naphthalen-1-yloxyethyl)thiomorpholine
SMILESc1ccc2c(OCCN3CCSCC3)cccc2c1
InChIInChI=1S/C16H19NOS/c1-2-6-15-14(4-1)5-3-7-16(15)18-11-8-17-9-12-19-13-10-17/h1-7H,8-13H2
InChIKeyMETUNFIMGSWKCY-UHFFFAOYSA-N
XLogP3.27
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.40
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-naphthalen-1-yloxyethyl)piperidin-4-one
CID 39368285
4-[2-(2-methylphenoxy)ethyl]thiomorpholine
CID 86993650
2-(2-thiomorpholin-4-ylethoxy)benzoic acid
CID 43532595
1-(2-naphthalen-1-yloxyethyl)-4-pyrrolidin-1-ylpiperidine
CID 48568943
1-(4-naphthalen-1-yloxybutyl)azepane
CID 2195259
1-(2-naphthalen-1-yloxyethyl)pyrrolidin-3-amine
CID 71151906
methane;1-(5-naphthalen-1-yloxypentyl)pyrrolidine
CID 160697643
[1-(2-naphthalen-1-yloxyethyl)azetidin-3-yl]methanamine
CID 71151801
1-(2-naphthalen-1-yloxyethyl)-4-(triazol-1-yl)piperidine
CID 71910805
N'-(2-naphthalen-1-yloxyethyl)thiomorpholine-4-carboximidamide
CID 111074015
4-(naphthalen-1-ylmethyl)thiomorpholine
CID 791354
N-[[2-[2-(1,4-thiazepan-4-yl)ethoxy]phenyl]methyl]propan-2-amine
CID 62413103

Frequently Asked Questions

What is the IUPAC name of 4-(2-naphthalen-1-yloxyethyl)thiomorpholine?
The IUPAC name of 4-(2-naphthalen-1-yloxyethyl)thiomorpholine (CID 48568928) is 4-(2-naphthalen-1-yloxyethyl)thiomorpholine.
What is the SMILES notation for 4-(2-naphthalen-1-yloxyethyl)thiomorpholine?
The canonical SMILES for 4-(2-naphthalen-1-yloxyethyl)thiomorpholine is c1ccc2c(OCCN3CCSCC3)cccc2c1.
What is the InChIKey of 4-(2-naphthalen-1-yloxyethyl)thiomorpholine?
The InChIKey is METUNFIMGSWKCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NOS/c1-2-6-15-14(4-1)5-3-7-16(15)18-11-8-17-9-12-19-13-10-17/h1-7H,8-13H2.
What are the key properties of 4-(2-naphthalen-1-yloxyethyl)thiomorpholine?
4-(2-naphthalen-1-yloxyethyl)thiomorpholine has a molecular weight of 273.40 g/mol, XLogP of 3.27, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-naphthalen-1-yloxyethyl)thiomorpholine is sourced from PubChem (CID 48568928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).