2-[2-(thian-4-yloxy)phenyl]morpholine

C15H21NO2S — CID 117448476

IUPAC2-[2-(thian-4-yloxy)phenyl]morpholine
SMILESc1ccc(C2CNCCO2)c(OC2CCSCC2)c1
InChIInChI=1S/C15H21NO2S/c1-2-4-14(18-12-5-9-19-10-6-12)13(3-1)15-11-16-7-8-17-15/h1-4,12,15-16H,5-11H2
InChIKeyNWJAKJIYGFWLEW-UHFFFAOYSA-N
MW279.40 g/mol
LogP2.62
Rot. Bonds3

About 2-[2-(thian-4-yloxy)phenyl]morpholine

2-[2-(thian-4-yloxy)phenyl]morpholine (PubChem CID 117448476) has the molecular formula C15H21NO2S and a molecular weight of 279.40 g/mol. Its IUPAC name is 2-[2-(thian-4-yloxy)phenyl]morpholine.

Molecular Properties

Compound Name2-[2-(thian-4-yloxy)phenyl]morpholine
PubChem CID117448476
Molecular FormulaC15H21NO2S
Molecular Weight279.40 g/mol
Exact Mass279.13
IUPAC Name2-[2-(thian-4-yloxy)phenyl]morpholine
SMILESc1ccc(C2CNCCO2)c(OC2CCSCC2)c1
InChIInChI=1S/C15H21NO2S/c1-2-4-14(18-12-5-9-19-10-6-12)13(3-1)15-11-16-7-8-17-15/h1-4,12,15-16H,5-11H2
InChIKeyNWJAKJIYGFWLEW-UHFFFAOYSA-N
XLogP2.62
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.40
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-[2-(thian-4-yloxy)phenyl]morpholine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(5-bromo-2-cyclopropyloxyphenyl)morpholine
CID 117479953
2-(2-cyclopentyloxy-6-methylphenyl)morpholine
CID 117407960
2-[2-(1-fluoroethyl)-3-methoxyphenyl]morpholine
CID 117350776
3-[2-(oxan-4-yloxy)phenyl]piperidine
CID 117408165
2-(thian-4-yloxy)aniline
CID 14819600
2-morpholin-2-ylbenzonitrile;hydrochloride
CID 77492763
2-[2-(1,1-difluoroethyl)phenyl]morpholine
CID 117326792
4-(thian-4-yloxy)-2,3-dihydro-1H-indole
CID 115074331
(3R)-3-(2-piperidin-4-ylphenoxy)piperidine
CID 58817373
azane;2-phenylmorpholine
CID 174664757
2-(2-methoxy-4-methylphenyl)morpholine
CID 82611084
4-(2-cyclopentyloxyphenyl)piperidine
CID 156722248

Frequently Asked Questions

What is the IUPAC name of 2-[2-(thian-4-yloxy)phenyl]morpholine?
The IUPAC name of 2-[2-(thian-4-yloxy)phenyl]morpholine (CID 117448476) is 2-[2-(thian-4-yloxy)phenyl]morpholine.
What is the SMILES notation for 2-[2-(thian-4-yloxy)phenyl]morpholine?
The canonical SMILES for 2-[2-(thian-4-yloxy)phenyl]morpholine is c1ccc(C2CNCCO2)c(OC2CCSCC2)c1.
What is the InChIKey of 2-[2-(thian-4-yloxy)phenyl]morpholine?
The InChIKey is NWJAKJIYGFWLEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2S/c1-2-4-14(18-12-5-9-19-10-6-12)13(3-1)15-11-16-7-8-17-15/h1-4,12,15-16H,5-11H2.
What are the key properties of 2-[2-(thian-4-yloxy)phenyl]morpholine?
2-[2-(thian-4-yloxy)phenyl]morpholine has a molecular weight of 279.40 g/mol, XLogP of 2.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(thian-4-yloxy)phenyl]morpholine is sourced from PubChem (CID 117448476), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).