3-[(2,3-dichlorophenyl)methyl]morpholine

C11H13Cl2NO — CID 82294990

IUPAC3-[(2,3-dichlorophenyl)methyl]morpholine
SMILESClc1cccc(CC2COCCN2)c1Cl
InChIInChI=1S/C11H13Cl2NO/c12-10-3-1-2-8(11(10)13)6-9-7-15-5-4-14-9/h1-3,9,14H,4-7H2
InChIKeyKCLCDXRGLOGTOB-UHFFFAOYSA-N
MW246.14 g/mol
LogP2.52
Rot. Bonds2

About 3-[(2,3-dichlorophenyl)methyl]morpholine

3-[(2,3-dichlorophenyl)methyl]morpholine (PubChem CID 82294990) has the molecular formula C11H13Cl2NO and a molecular weight of 246.14 g/mol. Its IUPAC name is 3-[(2,3-dichlorophenyl)methyl]morpholine.

Molecular Properties

Compound Name3-[(2,3-dichlorophenyl)methyl]morpholine
PubChem CID82294990
Molecular FormulaC11H13Cl2NO
Molecular Weight246.14 g/mol
Exact Mass245.04
IUPAC Name3-[(2,3-dichlorophenyl)methyl]morpholine
SMILESClc1cccc(CC2COCCN2)c1Cl
InChIInChI=1S/C11H13Cl2NO/c12-10-3-1-2-8(11(10)13)6-9-7-15-5-4-14-9/h1-3,9,14H,4-7H2
InChIKeyKCLCDXRGLOGTOB-UHFFFAOYSA-N
XLogP2.52
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.14
LogP ≤ 52.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(naphthalen-1-ylmethyl)morpholine
CID 66932689
3-(naphthalen-1-ylmethyl)morpholine;hydrochloride
CID 129319991
3-[3-(2,3-dichlorophenyl)-2-fluoro-2-methylpropyl]morpholine
CID 107311248
3-[(2-chloro-6-fluorophenyl)methyl]morpholine
CID 82288651
3-[(4-chloro-2-methylphenyl)methyl]morpholine
CID 82287728
N-[(2,3-dichlorophenyl)methyl]-N-methylmorpholine-3-carboxamide;hydrochloride
CID 119682446
3-[(5-chloro-2-methoxyphenyl)methyl]morpholine
CID 82293165
3-[(5-chloro-2-methoxy-4-methylphenyl)methyl]morpholine
CID 116927929
2-[(2-chlorophenyl)methyl]azetidine
CID 84658268
2-[(2,3-dichlorophenyl)methyl]-1,3-dioxole
CID 71772683
(3R)-3-(2,6-dichlorophenyl)morpholine;hydrochloride
CID 171192450
3-[(1-naphthalen-2-ylindol-4-yl)methyl]morpholine;hydrochloride
CID 164522707

Frequently Asked Questions

What is the IUPAC name of 3-[(2,3-dichlorophenyl)methyl]morpholine?
The IUPAC name of 3-[(2,3-dichlorophenyl)methyl]morpholine (CID 82294990) is 3-[(2,3-dichlorophenyl)methyl]morpholine.
What is the SMILES notation for 3-[(2,3-dichlorophenyl)methyl]morpholine?
The canonical SMILES for 3-[(2,3-dichlorophenyl)methyl]morpholine is Clc1cccc(CC2COCCN2)c1Cl.
What is the InChIKey of 3-[(2,3-dichlorophenyl)methyl]morpholine?
The InChIKey is KCLCDXRGLOGTOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13Cl2NO/c12-10-3-1-2-8(11(10)13)6-9-7-15-5-4-14-9/h1-3,9,14H,4-7H2.
What are the key properties of 3-[(2,3-dichlorophenyl)methyl]morpholine?
3-[(2,3-dichlorophenyl)methyl]morpholine has a molecular weight of 246.14 g/mol, XLogP of 2.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,3-dichlorophenyl)methyl]morpholine is sourced from PubChem (CID 82294990), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).