(3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride

C10H12Cl3NO — CID 171192450

IUPAC(3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride
SMILESCl.Clc1cccc(Cl)c1[C@@H]1COCCN1
InChIInChI=1S/C10H11Cl2NO.ClH/c11-7-2-1-3-8(12)10(7)9-6-14-5-4-13-9;/h1-3,9,13H,4-6H2;1H/t9-;/m0./s1
InChIKeyYKQSISREBFRTKU-FVGYRXGTSA-N
MW268.57 g/mol
LogP3.08
Rot. Bonds1

About (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride

(3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride (PubChem CID 171192450) has the molecular formula C10H12Cl3NO and a molecular weight of 268.57 g/mol. Its IUPAC name is (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride.

Molecular Properties

Compound Name(3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride
PubChem CID171192450
Molecular FormulaC10H12Cl3NO
Molecular Weight268.57 g/mol
Exact Mass267.00
IUPAC Name(3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride
SMILESCl.Clc1cccc(Cl)c1[C@@H]1COCCN1
InChIInChI=1S/C10H11Cl2NO.ClH/c11-7-2-1-3-8(12)10(7)9-6-14-5-4-13-9;/h1-3,9,13H,4-6H2;1H/t9-;/m0./s1
InChIKeyYKQSISREBFRTKU-FVGYRXGTSA-N
XLogP3.08
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.57
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-3-(2-chloro-6-methylphenyl)morpholine
CID 131168891
3-(2,6-dimethylphenyl)morpholine
CID 55298000
(3R)-3-(2,3-dichloro-6-fluorophenyl)morpholine;hydrochloride
CID 171192935
(3R)-3-(3-chloro-2,6-difluorophenyl)morpholine
CID 131546881
(2S)-2-(2,6-dichlorophenyl)azetidine;hydrochloride
CID 171196615
(3R)-3-(2-chloro-3,6-difluorophenyl)morpholine
CID 97291243
(3S)-3-(5,6-dichloro-2-pyridinyl)morpholine
CID 130706269
(3S)-3-(2-chloro-6-fluoro-3-methylphenyl)morpholine;hydrochloride
CID 171193285
3-bromo-6-chloro-2-[(3S)-morpholin-3-yl]phenol
CID 131447436
(3R)-3-(2-chloroquinolin-3-yl)morpholine;hydrochloride
CID 171192924
(3R)-3-(3-chlorothiophen-2-yl)morpholine
CID 96860760
3-(2-chlorophenyl)-1,4-oxazepane
CID 131296603

Frequently Asked Questions

What is the IUPAC name of (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride?
The IUPAC name of (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride (CID 171192450) is (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride.
What is the SMILES notation for (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride?
The canonical SMILES for (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride is Cl.Clc1cccc(Cl)c1[C@@H]1COCCN1.
What is the InChIKey of (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride?
The InChIKey is YKQSISREBFRTKU-FVGYRXGTSA-N. The full InChI is InChI=1S/C10H11Cl2NO.ClH/c11-7-2-1-3-8(12)10(7)9-6-14-5-4-13-9;/h1-3,9,13H,4-6H2;1H/t9-;/m0./s1.
What are the key properties of (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride?
(3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride has a molecular weight of 268.57 g/mol, XLogP of 3.08, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride is sourced from PubChem (CID 171192450), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).