4-(3-phenylpropylsulfonyl)morpholine

C13H19NO3S — CID 560201

IUPAC4-(3-phenylpropylsulfonyl)morpholine
SMILESO=S(=O)(CCCc1ccccc1)N1CCOCC1
InChIInChI=1S/C13H19NO3S/c15-18(16,14-8-10-17-11-9-14)12-4-7-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2
InChIKeyNZNVZBOVUXBAJO-UHFFFAOYSA-N
MW269.37 g/mol
LogP1.28
Rot. Bonds5

About 4-(3-phenylpropylsulfonyl)morpholine

4-(3-phenylpropylsulfonyl)morpholine (PubChem CID 560201) has the molecular formula C13H19NO3S and a molecular weight of 269.37 g/mol. Its IUPAC name is 4-(3-phenylpropylsulfonyl)morpholine.

Molecular Properties

Compound Name4-(3-phenylpropylsulfonyl)morpholine
PubChem CID560201
Molecular FormulaC13H19NO3S
Molecular Weight269.37 g/mol
Exact Mass269.11
IUPAC Name4-(3-phenylpropylsulfonyl)morpholine
SMILESO=S(=O)(CCCc1ccccc1)N1CCOCC1
InChIInChI=1S/C13H19NO3S/c15-18(16,14-8-10-17-11-9-14)12-4-7-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2
InChIKeyNZNVZBOVUXBAJO-UHFFFAOYSA-N
XLogP1.28
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.37
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-ethylsulfonyl-4-(3-phenylpropylsulfonyl)piperazine
CID 110819016
1-benzyl-4-(3-phenylpropylsulfonyl)piperazine
CID 113073931
morpholin-4-yl-[1-(3-phenylpropylsulfonyl)piperidin-3-yl]methanone
CID 46770435
1-(cyclopropylmethyl)-4-(3-phenylpropylsulfonyl)piperazine
CID 110708725
2-(4-fluorophenyl)-4-(3-phenylpropylsulfonyl)morpholine
CID 110326810
2-(4-methylphenyl)-4-(3-phenylpropylsulfonyl)morpholine
CID 110326607
1-(3-phenylpropylsulfonyl)-4-propan-2-yloxypiperidine
CID 110725489
2-(4-ethylphenyl)-4-(3-phenylpropylsulfonyl)morpholine
CID 110364078
4-[1-(3-phenylpropylsulfonyl)-2,3-dihydroindol-5-yl]morpholine
CID 110316286
[4-(3-phenylpropylsulfonyl)piperazin-1-yl]-pyridin-4-ylmethanone
CID 110364704
4-[(E)-4-phenylbut-1-enyl]sulfonylmorpholine
CID 10945886
(3S)-N-(3-morpholin-4-ylpropyl)-1-(3-phenylpropylsulfonyl)piperidine-3-carboxamide
CID 92677076

Frequently Asked Questions

What is the IUPAC name of 4-(3-phenylpropylsulfonyl)morpholine?
The IUPAC name of 4-(3-phenylpropylsulfonyl)morpholine (CID 560201) is 4-(3-phenylpropylsulfonyl)morpholine.
What is the SMILES notation for 4-(3-phenylpropylsulfonyl)morpholine?
The canonical SMILES for 4-(3-phenylpropylsulfonyl)morpholine is O=S(=O)(CCCc1ccccc1)N1CCOCC1.
What is the InChIKey of 4-(3-phenylpropylsulfonyl)morpholine?
The InChIKey is NZNVZBOVUXBAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3S/c15-18(16,14-8-10-17-11-9-14)12-4-7-13-5-2-1-3-6-13/h1-3,5-6H,4,7-12H2.
What are the key properties of 4-(3-phenylpropylsulfonyl)morpholine?
4-(3-phenylpropylsulfonyl)morpholine has a molecular weight of 269.37 g/mol, XLogP of 1.28, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-phenylpropylsulfonyl)morpholine is sourced from PubChem (CID 560201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).