2-(4-cyclopropylsulfonylphenyl)morpholine

C13H17NO3S — CID 117421824

IUPAC2-(4-cyclopropylsulfonylphenyl)morpholine
SMILESO=S(=O)(c1ccc(C2CNCCO2)cc1)C1CC1
InChIInChI=1S/C13H17NO3S/c15-18(16,12-5-6-12)11-3-1-10(2-4-11)13-9-14-7-8-17-13/h1-4,12-14H,5-9H2
InChIKeyZEFGLXYGGSFHLV-UHFFFAOYSA-N
MW267.35 g/mol
LogP1.28
Rot. Bonds3

About 2-(4-cyclopropylsulfonylphenyl)morpholine

2-(4-cyclopropylsulfonylphenyl)morpholine (PubChem CID 117421824) has the molecular formula C13H17NO3S and a molecular weight of 267.35 g/mol. Its IUPAC name is 2-(4-cyclopropylsulfonylphenyl)morpholine.

Molecular Properties

Compound Name2-(4-cyclopropylsulfonylphenyl)morpholine
PubChem CID117421824
Molecular FormulaC13H17NO3S
Molecular Weight267.35 g/mol
Exact Mass267.09
IUPAC Name2-(4-cyclopropylsulfonylphenyl)morpholine
SMILESO=S(=O)(c1ccc(C2CNCCO2)cc1)C1CC1
InChIInChI=1S/C13H17NO3S/c15-18(16,12-5-6-12)11-3-1-10(2-4-11)13-9-14-7-8-17-13/h1-4,12-14H,5-9H2
InChIKeyZEFGLXYGGSFHLV-UHFFFAOYSA-N
XLogP1.28
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.35
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-cyclopropylsulfonylphenyl)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

(2S)-2-(4-methylsulfonylphenyl)morpholine
CID 93302356
3-(4-cyclopropylsulfonylphenyl)piperidine
CID 117417990
2-(4-piperidin-4-ylphenyl)morpholine
CID 117368630
(2R)-2-(4-chlorophenyl)morpholine;hydrochloride
CID 119056973
2-(4-fluorophenyl)sulfonylmorpholine
CID 117037120
4-[(2R)-morpholin-2-yl]benzoic acid
CID 96582723
azane;2-phenylmorpholine
CID 174664757
2-[4-(trifluoromethyl)phenyl]morpholine
CID 3756313
2-(benzenesulfonyl)morpholine
CID 19848023
2-(4-propan-2-ylphenyl)sulfonylmorpholine
CID 117037126
3-(4-cyclohexylsulfonylphenyl)azetidine
CID 162745912
2-(3,4-dimethylphenyl)morpholine
CID 43169342

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclopropylsulfonylphenyl)morpholine?
The IUPAC name of 2-(4-cyclopropylsulfonylphenyl)morpholine (CID 117421824) is 2-(4-cyclopropylsulfonylphenyl)morpholine.
What is the SMILES notation for 2-(4-cyclopropylsulfonylphenyl)morpholine?
The canonical SMILES for 2-(4-cyclopropylsulfonylphenyl)morpholine is O=S(=O)(c1ccc(C2CNCCO2)cc1)C1CC1.
What is the InChIKey of 2-(4-cyclopropylsulfonylphenyl)morpholine?
The InChIKey is ZEFGLXYGGSFHLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO3S/c15-18(16,12-5-6-12)11-3-1-10(2-4-11)13-9-14-7-8-17-13/h1-4,12-14H,5-9H2.
What are the key properties of 2-(4-cyclopropylsulfonylphenyl)morpholine?
2-(4-cyclopropylsulfonylphenyl)morpholine has a molecular weight of 267.35 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclopropylsulfonylphenyl)morpholine is sourced from PubChem (CID 117421824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).