3-(3,4-dichlorophenyl)sulfanylmorpholine

C10H11Cl2NOS — CID 117034223

IUPAC3-(3,4-dichlorophenyl)sulfanylmorpholine
SMILESClc1ccc(SC2COCCN2)cc1Cl
InChIInChI=1S/C10H11Cl2NOS/c11-8-2-1-7(5-9(8)12)15-10-6-14-4-3-13-10/h1-2,5,10,13H,3-4,6H2
InChIKeyIGZUECBORYRFEP-UHFFFAOYSA-N
MW264.18 g/mol
LogP3.03
Rot. Bonds2

About 3-(3,4-dichlorophenyl)sulfanylmorpholine

3-(3,4-dichlorophenyl)sulfanylmorpholine (PubChem CID 117034223) has the molecular formula C10H11Cl2NOS and a molecular weight of 264.18 g/mol. Its IUPAC name is 3-(3,4-dichlorophenyl)sulfanylmorpholine.

Molecular Properties

Compound Name3-(3,4-dichlorophenyl)sulfanylmorpholine
PubChem CID117034223
Molecular FormulaC10H11Cl2NOS
Molecular Weight264.18 g/mol
Exact Mass262.99
IUPAC Name3-(3,4-dichlorophenyl)sulfanylmorpholine
SMILESClc1ccc(SC2COCCN2)cc1Cl
InChIInChI=1S/C10H11Cl2NOS/c11-8-2-1-7(5-9(8)12)15-10-6-14-4-3-13-10/h1-2,5,10,13H,3-4,6H2
InChIKeyIGZUECBORYRFEP-UHFFFAOYSA-N
XLogP3.03
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.18
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(3,4-dimethylphenyl)sulfanylmorpholine
CID 117034214
3-(3-methylphenyl)sulfanylmorpholine
CID 117034237
3-(2,5-dichlorophenyl)morpholine
CID 126971180
3-[(4-chloro-3-methylphenyl)sulfanylmethyl]morpholine
CID 117034360
2-(3,4-dichlorophenyl)-1-morpholin-3-ylethanone
CID 116576172
2-(4-chloro-3-methylphenyl)sulfanylpyrrolidine
CID 117033017
(3S)-3-(3-bromo-4-chlorophenyl)morpholine
CID 130748628
(3R)-3-(3,4-dichlorophenyl)sulfanylpyrrolidine
CID 94844656
3-(2,5-dimethoxyphenyl)sulfanylmorpholine
CID 117034229
(3S)-3-(5,6-dichloro-2-pyridinyl)morpholine
CID 130706269
bis(3-(3,4-dichlorophenyl)sulfanylpyrrolidine);hydrate;dihydrochloride
CID 131714712
3-[(Z)-3-(3,4-dichlorophenyl)-2-methylprop-2-enyl]morpholine
CID 113462311

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dichlorophenyl)sulfanylmorpholine?
The IUPAC name of 3-(3,4-dichlorophenyl)sulfanylmorpholine (CID 117034223) is 3-(3,4-dichlorophenyl)sulfanylmorpholine.
What is the SMILES notation for 3-(3,4-dichlorophenyl)sulfanylmorpholine?
The canonical SMILES for 3-(3,4-dichlorophenyl)sulfanylmorpholine is Clc1ccc(SC2COCCN2)cc1Cl.
What is the InChIKey of 3-(3,4-dichlorophenyl)sulfanylmorpholine?
The InChIKey is IGZUECBORYRFEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11Cl2NOS/c11-8-2-1-7(5-9(8)12)15-10-6-14-4-3-13-10/h1-2,5,10,13H,3-4,6H2.
What are the key properties of 3-(3,4-dichlorophenyl)sulfanylmorpholine?
3-(3,4-dichlorophenyl)sulfanylmorpholine has a molecular weight of 264.18 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dichlorophenyl)sulfanylmorpholine is sourced from PubChem (CID 117034223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).