4-[(E)-2-phenylethenyl]thiomorpholine

C12H15NS — CID 146169340

IUPAC4-[(E)-2-phenylethenyl]thiomorpholine
SMILESC(=C/N1CCSCC1)\c1ccccc1
InChIInChI=1S/C12H15NS/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13/h1-7H,8-11H2/b7-6+
InChIKeyAMDNGCCMJKHGNC-VOTSOKGWSA-N
MW205.33 g/mol
LogP2.71
Rot. Bonds2

About 4-[(E)-2-phenylethenyl]thiomorpholine

4-[(E)-2-phenylethenyl]thiomorpholine (PubChem CID 146169340) has the molecular formula C12H15NS and a molecular weight of 205.33 g/mol. Its IUPAC name is 4-[(E)-2-phenylethenyl]thiomorpholine.

Molecular Properties

Compound Name4-[(E)-2-phenylethenyl]thiomorpholine
PubChem CID146169340
Molecular FormulaC12H15NS
Molecular Weight205.33 g/mol
Exact Mass205.09
IUPAC Name4-[(E)-2-phenylethenyl]thiomorpholine
SMILESC(=C/N1CCSCC1)\c1ccccc1
InChIInChI=1S/C12H15NS/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13/h1-7H,8-11H2/b7-6+
InChIKeyAMDNGCCMJKHGNC-VOTSOKGWSA-N
XLogP2.71
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500205.33
LogP ≤ 52.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(E)-2-phenylethenyl]azepane
CID 146169339
iodomethane;1-[(E)-2-phenylethenyl]piperidine
CID 20839071
4-methyl-1-(2-phenylethenyl)piperidine
CID 174298455
4-[(E)-2-phenylethenyl]-1,4-thiazinane 1,1-dioxide
CID 58283179
N-methyl-1-(2-phenylethenyl)piperidin-4-amine
CID 174773972
(3S)-3-chloro-1-(2-phenylethenyl)piperidine
CID 174317120
(2R)-2-methyl-1-[(E)-2-phenylethenyl]pyrrolidine
CID 134863569
1-(2-phenoxyethyl)-4-(2-phenylethenyl)piperazine
CID 174650325
CID 70569152
CID 70569152
CID 70567885
CID 70567885
1-[(E)-2-(4-bromophenyl)ethenyl]piperidine
CID 146169747
(E)-3-phenyl-N-[3-(thiomorpholin-4-ylmethyl)phenyl]prop-2-enamide
CID 10830868

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-phenylethenyl]thiomorpholine?
The IUPAC name of 4-[(E)-2-phenylethenyl]thiomorpholine (CID 146169340) is 4-[(E)-2-phenylethenyl]thiomorpholine.
What is the SMILES notation for 4-[(E)-2-phenylethenyl]thiomorpholine?
The canonical SMILES for 4-[(E)-2-phenylethenyl]thiomorpholine is C(=C/N1CCSCC1)\c1ccccc1.
What is the InChIKey of 4-[(E)-2-phenylethenyl]thiomorpholine?
The InChIKey is AMDNGCCMJKHGNC-VOTSOKGWSA-N. The full InChI is InChI=1S/C12H15NS/c1-2-4-12(5-3-1)6-7-13-8-10-14-11-9-13/h1-7H,8-11H2/b7-6+.
What are the key properties of 4-[(E)-2-phenylethenyl]thiomorpholine?
4-[(E)-2-phenylethenyl]thiomorpholine has a molecular weight of 205.33 g/mol, XLogP of 2.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-phenylethenyl]thiomorpholine is sourced from PubChem (CID 146169340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).