4-[1-(furan-2-yl)ethyl]thiomorpholine

C10H15NOS — CID 130749822

IUPAC4-[1-(furan-2-yl)ethyl]thiomorpholine
SMILESCC(c1ccco1)N1CCSCC1
InChIInChI=1S/C10H15NOS/c1-9(10-3-2-6-12-10)11-4-7-13-8-5-11/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyXAUWBSLBTDBMTR-UHFFFAOYSA-N
MW197.30 g/mol
LogP2.39
Rot. Bonds2

About 4-[1-(furan-2-yl)ethyl]thiomorpholine

4-[1-(furan-2-yl)ethyl]thiomorpholine (PubChem CID 130749822) has the molecular formula C10H15NOS and a molecular weight of 197.30 g/mol. Its IUPAC name is 4-[1-(furan-2-yl)ethyl]thiomorpholine.

Molecular Properties

Compound Name4-[1-(furan-2-yl)ethyl]thiomorpholine
PubChem CID130749822
Molecular FormulaC10H15NOS
Molecular Weight197.30 g/mol
Exact Mass197.09
IUPAC Name4-[1-(furan-2-yl)ethyl]thiomorpholine
SMILESCC(c1ccco1)N1CCSCC1
InChIInChI=1S/C10H15NOS/c1-9(10-3-2-6-12-10)11-4-7-13-8-5-11/h2-3,6,9H,4-5,7-8H2,1H3
InChIKeyXAUWBSLBTDBMTR-UHFFFAOYSA-N
XLogP2.39
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.30
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[1-[(1S)-1-(furan-2-yl)ethyl]piperidin-4-yl]methanol
CID 95934404
1-[1-(furan-2-yl)ethyl]pyrrolidin-3-one
CID 43535702
1-[1-(furan-2-yl)ethyl]pyrrolidin-3-amine
CID 43535712
(3S)-1-[1-(furan-2-yl)ethyl]piperidin-3-ol
CID 71633408
1-[1-(furan-2-yl)ethyl]-4-methylpyrrolidin-3-amine
CID 103575099
[(3S)-1-[(1S)-1-(furan-2-yl)ethyl]pyrrolidin-3-yl]methanamine
CID 98085589
1-[1-(furan-2-yl)ethyl]-3,7-dimethyl-1,5-diazocane
CID 54973303
1-[1-(furan-2-yl)ethyl]-4-(3,4,5-trimethoxyphenyl)piperazine
CID 86817748
1-[1-(furan-2-yl)ethyl]-3-(trifluoromethyl)pyrrolidine-3-carboxylic acid
CID 65060663
2-[1-[1-(furan-2-yl)ethyl]piperidin-4-yl]oxyacetic acid
CID 65065324
[(3S)-1-[(1R)-1-(furan-2-yl)ethyl]piperidin-3-yl]methanol
CID 129373082
1-[1-[1-(furan-2-yl)ethyl]pyrrolidin-3-yl]-N-methylmethanamine
CID 62512099

Frequently Asked Questions

What is the IUPAC name of 4-[1-(furan-2-yl)ethyl]thiomorpholine?
The IUPAC name of 4-[1-(furan-2-yl)ethyl]thiomorpholine (CID 130749822) is 4-[1-(furan-2-yl)ethyl]thiomorpholine.
What is the SMILES notation for 4-[1-(furan-2-yl)ethyl]thiomorpholine?
The canonical SMILES for 4-[1-(furan-2-yl)ethyl]thiomorpholine is CC(c1ccco1)N1CCSCC1.
What is the InChIKey of 4-[1-(furan-2-yl)ethyl]thiomorpholine?
The InChIKey is XAUWBSLBTDBMTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NOS/c1-9(10-3-2-6-12-10)11-4-7-13-8-5-11/h2-3,6,9H,4-5,7-8H2,1H3.
What are the key properties of 4-[1-(furan-2-yl)ethyl]thiomorpholine?
4-[1-(furan-2-yl)ethyl]thiomorpholine has a molecular weight of 197.30 g/mol, XLogP of 2.39, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(furan-2-yl)ethyl]thiomorpholine is sourced from PubChem (CID 130749822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).